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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S2/c1-3-4-10-19(24)22-20(27)21-17-11-13-18(14-12-17)28(25,26)23(2)15-16-8-6-5-7-9-16/h5-9,11-14H,3-4,10,15H2,1-2H3,(H2,21,22,24,27)