2-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(m-tolyl)benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H29N3O4S/c1-20-10-8-12-22(18-20)28-27(32)24-14-4-5-15-25(24)29-26(31)21-11-9-13-23(19-21)35(33,34)30-16-6-2-3-7-17-30/h4-5,8-15,18-19H,2-3,6-7,16-17H2,1H3,(H,28,32)(H,29,31)