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

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-methyl-N-phenyl-acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)anilino]-N-methyl-N-phenylacetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-methyl-N-phenylacetamide Traditional Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-methyl-N-phenyl-acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)CNC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)CNC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C21H27N3O3S/c1-23(19-11-5-4-6-12-19)21(25)17-22-18-10-9-13-20(16-18)28(26,27)24-14-7-2-3-8-15-24/h4-6,9-13,16,22H,2-3,7-8,14-15,17H2,1H3