4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(2-methyl-6-propan-2-yl-phenyl)butanamide

Systemtic Name: 4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(2-methyl-6-propan-2-yl-phenyl)butanamide Openeye Name: 4-(4-chloro-N-methylsulfonyl-anilino)-N-(2-isopropyl-6-methyl-phenyl)butanamide CAS Name: 4-(4-chloro-N-methylsulfonylanilino)-N-(2-methyl-6-propan-2-ylphenyl)butanamide IUPAC Name: 4-(4-chloro-N-methylsulfonylanilino)-N-(2-methyl-6-propan-2-ylphenyl)butanamide Traditional Name: 4-(4-chloro-N-mesyl-anilino)-N-(2-isopropyl-6-methyl-phenyl)butyramide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)CCCN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)CCCN(C2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C21H27ClN2O3S/c1-15(2)19-8-5-7-16(3)21(19)23-20(25)9-6-14-24(28(4,26)27)18-12-10-17(22)11-13-18/h5,7-8,10-13,15H,6,9,14H2,1-4H3,(H,23,25)