N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-3-(phenylsulfonylamino)benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-methyl-3-(phenylsulfonylamino)benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(benzenesulfonamido)-2-methyl-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-3-(benzenesulfonamido)-2-methylbenzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(benzenesulfonamido)-2-methylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-3-(benzenesulfonamido)-2-methyl-benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=CC=C1NS(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)N4CCCCCC4

InChI

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