2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2-methyl-6-propan-2-yl-phenyl)butanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2-methyl-6-propan-2-yl-phenyl)butanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-(2-isopropyl-6-methyl-phenyl)butanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-(2-methyl-6-propan-2-ylphenyl)butanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-(2-methyl-6-propan-2-ylphenyl)butanamide Traditional Name: 2-(3-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:

CCC(C(=O)NC1=C(C=CC=C1C(C)C)C)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC=C1C(C)C)C)N(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

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