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

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]-N-[3-(3-methylphenyl)propyl]butanamide Openeye Name: 4-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)-N-[3-(m-tolyl)propyl]butanamide CAS Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[3-(3-methylphenyl)propyl]butanamide IUPAC Name: 4-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[3-(3-methylphenyl)propyl]butanamide Traditional Name: 4-(3-chloro-N-mesyl-4-methoxy-anilino)-N-[3-(m-tolyl)propyl]butyramide Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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