N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-phenylethanoylamino)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-phenylethanoylamino)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(2-phenylacetyl)amino]benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-[(1-oxo-2-phenylethyl)amino]benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(2-phenylacetyl)amino]benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-[(2-phenylacetyl)amino]benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC(=O)CC4=CC=CC=C4

InChI

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