1-(6-Ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylene]-5-(3-nitrophenyl)-2,3-pyrrolidinedione

ChemSpider ID: 3479234
Molecular Formula: C₂₆H₁₈FN₃O₅S
Monoisotopic mass: 503.095123 Da
Systematic name

1-(6-Ethyl-1,3-benzothiazol-2-yl)-4-[(4-fluorophenyl)(hydroxy)methylene]-5-(3-nitrophenyl)-2,3-pyrrolidinedione
SMILES and InChIs

SMILES:

CCc1ccc2c(c1)sc(n2)N3C(C(=C(c4ccc(cc4)F)O)C(=O)C3=O)c5cccc(c5)[N+](=O)[O-] Copied

Std. InChI:

InChI=1S/C26H18FN3O5S/c1-2-14-6-11-19-20(12-14)36-26(28-19)29-22(16-4-3-5-18(13-16)30(34)35)21(24(32)25(29)33)23(31)15-7-9-17(27)10-8-15/h3-13,22,31H,2H2,1H3 Copied

Std. InChIKey:

UWFSWKFZGSEZNA-UHFFFAOYSA-N Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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