2-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(4-methoxyphenyl)benzamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]carbonylamino]-N-(4-methoxyphenyl)benzamide Openeye Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(4-methoxyphenyl)benzamide CAS Name: 2-[[[3-(1-azepanylsulfonyl)phenyl]-oxomethyl]amino]-N-(4-methoxyphenyl)benzamide IUPAC Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(4-methoxyphenyl)benzamide Traditional Name: 2-[[3-(azepan-1-ylsulfonyl)benzoyl]amino]-N-(4-methoxyphenyl)benzamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H29N3O5S/c1-35-22-15-13-21(14-16-22)28-27(32)24-11-4-5-12-25(24)29-26(31)20-9-8-10-23(19-20)36(33,34)30-17-6-2-3-7-18-30/h4-5,8-16,19H,2-3,6-7,17-18H2,1H3,(H,28,32)(H,29,31)