2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(diphenylmethyl)ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-benzhydryl-acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)anilino]-N-(diphenylmethyl)acetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-benzhydrylacetamide Traditional Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-benzhydryl-acetamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O3S/c31-26(29-27(22-12-5-3-6-13-22)23-14-7-4-8-15-23)21-28-24-16-11-17-25(20-24)34(32,33)30-18-9-1-2-10-19-30/h3-8,11-17,20,27-28H,1-2,9-10,18-19,21H2,(H,29,31)