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Found 54 results

Search term: MF = 'C_{27}H_{31}ClN_{6}O_{3}S'
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21563942
InChI=1/C27H31ClN6O3S/c1-19-17-25(33-13-11-32(12-14-33)23-6-4-3-5-22(23)28)30-27(29-19)38-18-21-7-8-24(37-21)26(36)34-15-9-31(10-16-34)20(2)35/h3-8,17H,9-16,18H2,1-2H3
C27H31ClN6O3S555.09147600
29266039
InChI=1/C27H31ClN6O3S/c1-18-24-26(29-15-16-30-38(35,36)23-13-11-22(37-2)12-14-23)31-25(19-7-4-3-5-8-19)32-27(24)34(33-18)21-10-6-9-20(28)17-21/h6,9-14,17,19,30H,3-5,7-8,15-16H2,1-2H3,(H,29,31,32)
C27H31ClN6O3S555.09146600
24653700

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C27H31ClN6O3S/c1-33(2)27(37)16-5-7-19(30-24(35)17-10-15-4-6-18(28)12-21(15)29-13-17)22(11-16)31-25(36)26-32-20-8-9-34(3)14-23(20)38-26/h4,6,10,12-13,16,19,22H,5,7-9,11,14H2,1-3H3,(H,30,35)(H,31,36)/t16-,19-,22+/m0/s1
C27H31ClN6O3S555.09145400
24655214

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C27H31ClN6O3S/c1-33(2)27(37)16-5-7-19(30-24(35)22-11-15-4-6-18(28)10-17(15)13-29-22)21(12-16)31-25(36)26-32-20-8-9-34(3)14-23(20)38-26/h4,6,10-11,13,16,19,21H,5,7-9,12,14H2,1-3H3,(H,30,35)(H,31,36)/t16-,19-,21+/m0/s1
C27H31ClN6O3S555.09145400
24653813

3 of 3 defined stereocentres - 3/3 defined
InChI=1/C27H31ClN6O3S/c1-33(2)27(37)16-5-7-19(30-24(35)21-8-4-15-12-17(28)6-9-18(15)29-21)22(13-16)31-25(36)26-32-20-10-11-34(3)14-23(20)38-26/h4,6,8-9,12,16,19,22H,5,7,10-11,13-14H2,1-3H3,(H,30,35)(H,31,36)/t16-,19-,22+/m0/s1
C27H31ClN6O3S555.09144300
88298524

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C27H31ClN6O3S/c28-20-8-6-18(7-9-20)19-5-3-4-17(12-19)13-30-10-1-2-11-38-14-21-23(35)24(36)27(37-21)34-16-33-22-25(29)31-15-32-26(22)34/h3-9,12,15-16,21,23-24,27,30,35-36H,1-2,10-11,13-14H2,(H2,29,31,32)/t21-,23-,24-,27-/m1/s1
C27H31ClN6O3S555.09144300
76728050
InChI=1/C27H31ClN6O3S/c1-4-21-14-19(10-11-29-21)17-30-22-16-25(28)32-34-26(18(2)31-27(22)34)20-8-9-23(37-3)24(15-20)38(35,36)33-12-6-5-7-13-33/h8-11,14-16,30H,4-7,12-13,17H2,1-3H3
C27H31ClN6O3S555.09143300
22784581
InChI=1/C27H31ClN6O3S/c1-17-5-6-20(28)14-23(17)34-18(2)13-22(31-34)25-19(3)30-27-33(26(25)36)21(16-38-27)15-24(35)29-7-4-8-32-9-11-37-12-10-32/h5-6,13-14,16H,4,7-12,15H2,1-3H3,(H,29,35)
C27H31ClN6O3S555.09143200
2722382
InChI=1/C27H31ClN6O3S/c1-27(2,37-22-6-4-3-5-20(22)28)26(36)34-11-7-19(8-12-34)24-31-21(18-38-24)25(35)33-15-13-32(14-16-33)23-17-29-9-10-30-23/h3-6,9-10,17-19H,7-8,11-16H2,1-2H3
C27H31ClN6O3S555.0914399999982100
3065385
InChI=1/C27H31ClN6O3S/c1-27(2,37-22-7-4-3-6-20(22)28)25(36)33-12-8-19(9-13-33)23-31-21(18-38-23)24(35)32-14-16-34(17-15-32)26-29-10-5-11-30-26/h3-7,10-11,18-19H,8-9,12-17H2,1-2H3
C27H31ClN6O3S555.09142100
3545526
InChI=1/C27H31ClN6O3S/c28-21-5-1-2-6-23(21)37-18-11-30-25(35)22-19-38-26(31-22)20-8-12-33(13-9-20)27(36)34-16-14-32(15-17-34)24-7-3-4-10-29-24/h1-7,10,19-20H,8-9,11-18H2,(H,30,35)
C27H31ClN6O3S555.0914399999982100
98645581

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C27H31ClN6O3S/c28-20-8-6-18(7-9-20)19-5-3-4-17(12-19)13-30-10-1-2-11-38-14-21-23(35)24(36)27(37-21)34-16-33-22-25(29)31-15-32-26(22)34/h3-9,12,15-16,21,23-24,27,30,35-36H,1-2,10-11,13-14H2,(H2,29,31,32)/t21-,23+,24?,27-/m1/s1
C27H31ClN6O3S555.09142200
100079635

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-6-12-34-26(19(4)30-21-10-8-18(3)9-11-21)32-33-27(34)38-17-24(35)31-29-16-20-14-22(28)25(37-13-7-2)23(15-20)36-5/h6-11,14-16,19,30H,1-2,12-13,17H2,3-5H3,(H,31,35)/b29-16-
C27H31ClN6O3S555.09141100
100079675

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-6-12-34-26(19(4)30-21-10-8-18(3)9-11-21)32-33-27(34)38-17-25(35)31-29-16-20-14-23(36-5)24(15-22(20)28)37-13-7-2/h6-11,14-16,19,30H,1-2,12-13,17H2,3-5H3,(H,31,35)/b29-16-
C27H31ClN6O3S555.09141100
100109081

Double-bond stereo
InChI=1/C27H31ClN6O3S/c1-5-9-20-13-19(14-23(36-7-3)26(20)37-12-6-2)16-30-32-25(35)18-38-27-33-31-24(34(27)4)17-29-22-11-8-10-21(28)15-22/h5-6,8,10-11,13-16,29H,1-2,7,9,12,17-18H2,3-4H3,(H,32,35)/b30-16-
C27H31ClN6O3S555.09141100
100368435

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-4-12-34-25(18-37-21-10-6-5-7-11-21)30-32-27(34)38-19(2)26(35)31-29-17-20-15-24(36-3)23(16-22(20)28)33-13-8-9-14-33/h4-7,10-11,15-17,19H,1,8-9,12-14,18H2,2-3H3,(H,31,35)/b29-17-
C27H31ClN6O3S555.09141100
82689110

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-4-13-34-26(18(2)30-22-10-8-21(28)9-11-22)32-33-27(34)38-17-25(35)31-29-15-20-7-12-23(36-3)24(14-20)37-16-19-5-6-19/h4,7-12,14-15,18-19,30H,1,5-6,13,16-17H2,2-3H3,(H,31,35)/b29-15-
C27H31ClN6O3S555.09141100
82689497

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-6-14-34-26(19(4)30-22-12-10-21(28)11-13-22)32-33-27(34)38-17-24(35)31-29-15-20-8-7-9-23(36-5)25(20)37-16-18(2)3/h6-13,15,19,30H,1-2,14,16-17H2,3-5H3,(H,31,35)/b29-15-
C27H31ClN6O3S555.09141100
82689774

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-6-15-34-24(18(2)30-22-13-11-21(28)12-14-22)32-33-26(34)38-17-23(35)31-29-16-19-7-9-20(10-8-19)25(36)37-27(3,4)5/h6-14,16,18,30H,1,15,17H2,2-5H3,(H,31,35)/b29-16-
C27H31ClN6O3S555.09141100
82690035

Double-bond stereo

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C27H31ClN6O3S/c1-3-14-34-26(19(2)30-22-8-6-21(28)7-9-22)32-33-27(34)38-18-25(35)31-29-17-20-4-10-23(11-5-20)37-24-12-15-36-16-13-24/h3-11,17,19,24,30H,1,12-16,18H2,2H3,(H,31,35)/b29-17-
C27H31ClN6O3S555.09141100
123

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