4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(3-methylphenyl)methyl]butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[(3-methylphenyl)methyl]butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(m-tolylmethyl)butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(3-methylphenyl)methyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(3-methylphenyl)methyl]butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(3-methylbenzyl)butyramide Formula: C20H25ClN2O4S MolecularWeight: 424.9415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN2O4S/c1-15-6-4-7-16(12-15)14-22-20(24)8-5-11-23(28(3,25)26)17-9-10-19(27-2)18(21)13-17/h4,6-7,9-10,12-13H,5,8,11,14H2,1-3H3,(H,22,24)