3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide CAS Name: N-(4-acetylphenyl)-3-[4-(1-azepanylsulfonyl)phenyl]propanamide IUPAC Name: N-(4-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Traditional Name: N-(4-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propionamide Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H28N2O4S/c1-18(26)20-9-11-21(12-10-20)24-23(27)15-8-19-6-13-22(14-7-19)30(28,29)25-16-4-2-3-5-17-25/h6-7,9-14H,2-5,8,15-17H2,1H3,(H,24,27)