3-methyl-N-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbamothioyl]butanamide Openeye Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[[4-[methyl-(phenylmethyl)sulfamoyl]anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]thiocarbamoyl]-3-methyl-butyramide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O3S2/c1-15(2)13-19(24)22-20(27)21-17-9-11-18(12-10-17)28(25,26)23(3)14-16-7-5-4-6-8-16/h4-12,15H,13-14H2,1-3H3,(H2,21,22,24,27)