2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(3-bromophenyl)-methylsulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide Openeye Name: 2-(3-bromo-N-methylsulfonyl-anilino)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide CAS Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide IUPAC Name: 2-(3-bromo-N-methylsulfonylanilino)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide Traditional Name: 2-(3-bromo-N-mesyl-anilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide Formula: C23H23BrN2O3S2 MolecularWeight: 519.47432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NC(=O)CN(C3=CC(=CC=C3)Br)S(=O)(=O)C

InChI

InChI=1S/C23H23BrN2O3S2/c1-17-13-18(16-30-21-9-4-3-5-10-21)11-12-22(17)25-23(27)15-26(31(2,28)29)20-8-6-7-19(24)14-20/h3-14H,15-16H2,1-2H3,(H,25,27)