N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-[N-(benzenesulfonyl)anilino]acetamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-[N-(benzenesulfonyl)anilino]acetamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-[N-(benzenesulfonyl)anilino]acetamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(N-besylanilino)acetamide Formula: C27H29N3O4S MolecularWeight: 491.60186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

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