N-[2-(azepan-1-ylcarbonyl)phenyl]-4-[(3-chlorophenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-4-[(3-chlorophenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-4-(3-chloro-N-methylsulfonyl-anilino)butanamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-4-(3-chloro-N-methylsulfonylanilino)butanamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-4-(3-chloro-N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-4-(3-chloro-N-mesyl-anilino)butyramide Formula: C24H30ClN3O4S MolecularWeight: 492.0307

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C24H30ClN3O4S/c1-33(31,32)28(20-11-8-10-19(25)18-20)17-9-14-23(29)26-22-13-5-4-12-21(22)24(30)27-15-6-2-3-7-16-27/h4-5,8,10-13,18H,2-3,6-7,9,14-17H2,1H3,(H,26,29)