Search

Exact match only
± (example: 123 ± 1)
±  
±    
±    
Options
Single/Multi-component


Isotopically Labeled


Additional Filters

Search Hits Limit:
49 hits found.
Search terms: MF = 'C_{22}H_{20}BrNO_{3}S'
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
1366124
InChI=1/C22H20BrNO3S/c1-4-27-22(26)19-18(17-9-8-13(2)10-14(17)3)12-28-21(19)24-20(25)15-6-5-7-16(23)11-15/h5-12H,4H2,1-3H3,(H,24,25)
C22H20BrNO3S458.3681171900
1368677
InChI=1/C22H20BrNO3S/c1-22(2,3)15-8-4-14(5-9-15)19(25)24-20-18(21(26)27)17(12-28-20)13-6-10-16(23)11-7-13/h4-12H,1-3H3,(H,24,25)(H,26,27)
C22H20BrNO3S458.3681131300
3832153
InChI=1/C22H20BrNO3S/c1-3-14-4-8-16(9-5-14)18-13-28-21(20(18)22(26)27-2)24-19(25)12-15-6-10-17(23)11-7-15/h4-11,13H,3,12H2,1-2H3,(H,24,25)
C22H20BrNO3S458.3681131300
1483766
InChI=1/C22H20BrNO3S/c1-3-27-20(25)13-16-12-19(22(26)24-18-10-8-17(23)9-11-18)28-21(16)15-6-4-14(2)5-7-15/h4-12H,3,13H2,1-2H3,(H,24,26)
C22H20BrNO3S458.3681101000
12246835

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrNO3S/c23-19-10-8-17(9-11-19)22(25)24(20-12-13-28(26,27)15-20)14-18-6-3-5-16-4-1-2-7-21(16)18/h1-11,20H,12-15H2
C22H20BrNO3S458.3681101200
3467175

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrNO3S/c1-26-18-12-14-9-10-24(22(25)15-6-3-4-7-17(15)23)21(20-8-5-11-28-20)16(14)13-19(18)27-2/h3-8,11-13,21H,9-10H2,1-2H3
C22H20BrNO3S458.36817700
11011886
InChI=1/C22H20BrNO3S/c1-26-20-12-16(22(25)24-17-9-6-10-18(13-17)28-2)11-19(23)21(20)27-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H,24,25)
C22H20BrNO3S458.36816600
21651963

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H20BrNO3S/c23-21-11-4-3-10-20(21)22(25)24(18-12-13-28(26,27)15-18)14-17-8-5-7-16-6-1-2-9-19(16)17/h1-11,18H,12-15H2
C22H20BrNO3S458.36816700
5056932

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C22H20BrNO3S/c23-16-8-11-18(12-9-16)28(26)14-17-10-13-21(27-17)22(25)24-20-7-3-5-15-4-1-2-6-19(15)20/h1-2,4,6,8-13,20H,3,5,7,14H2,(H,24,25)
C22H20BrNO3S458.36815500
1332488
InChI=1/C22H20BrNO3S/c1-2-27-22(26)20-18(16-9-11-17(23)12-10-16)14-28-21(20)24-19(25)13-8-15-6-4-3-5-7-15/h3-7,9-12,14H,2,8,13H2,1H3,(H,24,25)
C22H20BrNO3S458.36815600
1346368
InChI=1/C22H20BrNO3S/c1-3-14-5-7-15(8-6-14)18-13-28-21(19(18)22(26)27-4-2)24-20(25)16-9-11-17(23)12-10-16/h5-13H,3-4H2,1-2H3,(H,24,25)
C22H20BrNO3S458.36815500
1346372
InChI=1/C22H20BrNO3S/c1-3-14-9-11-15(12-10-14)17-13-28-21(19(17)22(26)27-4-2)24-20(25)16-7-5-6-8-18(16)23/h5-13H,3-4H2,1-2H3,(H,24,25)
C22H20BrNO3S458.36815500
1346487
InChI=1/C22H20BrNO3S/c1-3-14-8-10-15(11-9-14)18-13-28-21(19(18)22(26)27-4-2)24-20(25)16-6-5-7-17(23)12-16/h5-13H,3-4H2,1-2H3,(H,24,25)
C22H20BrNO3S458.36815500
2640413
InChI=1/C22H20BrNO3S/c1-4-27-22(26)19-18(15-7-9-17(23)10-8-15)12-28-21(19)24-20(25)16-6-5-13(2)14(3)11-16/h5-12H,4H2,1-3H3,(H,24,25)
C22H20BrNO3S458.36814400
3324007
InChI=1/C22H20BrNO3S/c1-13(2)14-4-6-16(7-5-14)20(25)24-21-19(22(26)27-3)18(12-28-21)15-8-10-17(23)11-9-15/h4-13H,1-3H3,(H,24,25)
C22H20BrNO3S458.36814400
1315820
InChI=1/C22H20BrNO3S/c1-4-27-22(26)19-18(16-6-5-13(2)14(3)11-16)12-28-21(19)24-20(25)15-7-9-17(23)10-8-15/h5-12H,4H2,1-3H3,(H,24,25)
C22H20BrNO3S458.36814400
3570825
InChI=1/C22H20BrNO3S/c1-14(2)27-22(26)20-18(16-6-4-3-5-7-16)13-28-21(20)24-19(25)12-15-8-10-17(23)11-9-15/h3-11,13-14H,12H2,1-2H3,(H,24,25)
C22H20BrNO3S458.36814400
3729242
InChI=1/C22H20BrNO3S/c1-2-27-22(26)19-16-7-3-4-12-18(16)28-21(19)24-20(25)15-10-5-9-14-13(15)8-6-11-17(14)23/h5-6,8-11H,2-4,7,12H2,1H3,(H,24,25)
C22H20BrNO3S458.36813300
4709323

Double-bond stereo
InChI=1/C22H20BrNO3S/c1-2-3-14-27-22(26)20-17-6-4-5-7-18(17)28-21(20)24-19(25)13-10-15-8-11-16(23)12-9-15/h4-13H,2-3,14H2,1H3,(H,24,25)/b13-10+
C22H20BrNO3S458.36813300
8225355
InChI=1/C22H20BrNO3S/c1-2-15-24(28(25,26)20-11-7-4-8-12-20)22-16-19(13-14-21(22)23)27-17-18-9-5-3-6-10-18/h2-14,16H,1,15,17H2
C22H20BrNO3S458.36813400
123
Feedback Form