4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-phenylbutan-2-yl)butanamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-(4-phenylbutan-2-yl)butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-(1-methyl-3-phenyl-propyl)butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(4-phenylbutan-2-yl)butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-(4-phenylbutan-2-yl)butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-(1-methyl-3-phenyl-propyl)butyramide Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CCCN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)CCCN(C2=CC(=C(C=C2)OC)Cl)S(=O)(=O)C

InChI

InChI=1S/C22H29ClN2O4S/c1-17(11-12-18-8-5-4-6-9-18)24-22(26)10-7-15-25(30(3,27)28)19-13-14-21(29-2)20(23)16-19/h4-6,8-9,13-14,16-17H,7,10-12,15H2,1-3H3,(H,24,26)