2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[1-(4-methylphenyl)propyl]butanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-[1-(4-methylphenyl)propyl]butanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-[1-(p-tolyl)propyl]butanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[1-(4-methylphenyl)propyl]butanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-[1-(4-methylphenyl)propyl]butanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-[1-(p-tolyl)propyl]butyramide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C(CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC(=O)C(CC)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O3S/c1-5-19(16-12-10-15(3)11-13-16)23-21(25)20(6-2)24(28(4,26)27)18-9-7-8-17(22)14-18/h7-14,19-20H,5-6H2,1-4H3,(H,23,25)