2-[(4-methylphenyl)-methylsulfonyl-amino]-N-phenyl-butanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-phenyl-butanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-phenyl-butanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-phenylbutanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-phenylbutanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-phenyl-butyramide Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C18H22N2O3S/c1-4-17(18(21)19-15-8-6-5-7-9-15)20(24(3,22)23)16-12-10-14(2)11-13-16/h5-13,17H,4H2,1-3H3,(H,19,21)