4-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-(3-chloro-N-methylsulfonyl-anilino)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-(3-chloro-N-methylsulfonylanilino)-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-(3-chloro-N-methylsulfonylanilino)-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-anilino)-N-mesityl-butyramide Formula: C20H25ClN2O3S MolecularWeight: 408.9421

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O3S/c1-14-11-15(2)20(16(3)12-14)22-19(24)9-6-10-23(27(4,25)26)18-8-5-7-17(21)13-18/h5,7-8,11-13H,6,9-10H2,1-4H3,(H,22,24)