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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=CC(=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC=CC(=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S/c31-26(23-12-9-15-25(19-23)35(33,34)30-16-6-1-2-7-17-30)28-20-21-10-8-11-22(18-21)27(32)29-24-13-4-3-5-14-24/h3-5,8-15,18-19H,1-2,6-7,16-17,20H2,(H,28,31)(H,29,32)