2-[(4-methoxyphenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-[4-(phenylsulfanylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(4-methoxyphenyl)-(4-methyl-3-nitro-phenyl)sulfonyl-amino]-N-[4-(phenylsulfanylmethyl)phenyl]ethanamide Openeye Name: 2-(4-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-[4-(phenylsulfanylmethyl)phenyl]acetamide CAS Name: 2-(4-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-[4-[(phenylthio)methyl]phenyl]acetamide IUPAC Name: 2-(4-methoxy-N-(4-methyl-3-nitrophenyl)sulfonylanilino)-N-[4-(phenylsulfanylmethyl)phenyl]acetamide Traditional Name: 2-(4-methoxy-N-(4-methyl-3-nitro-phenyl)sulfonyl-anilino)-N-[4-[(phenylthio)methyl]phenyl]acetamide Formula: C29H27N3O6S2 MolecularWeight: 577.67118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=C(C=C2)CSC3=CC=CC=C3)C4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C29H27N3O6S2/c1-21-8-17-27(18-28(21)32(34)35)40(36,37)31(24-13-15-25(38-2)16-14-24)19-29(33)30-23-11-9-22(10-12-23)20-39-26-6-4-3-5-7-26/h3-18H,19-20H2,1-2H3,(H,30,33)