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3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethanoylphenyl)propanamide

3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethanoylphenyl)propanamide

Systemtic Name:3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(2-ethanoylphenyl)propanamide
Openeye Name:N-(2-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide
CAS Name:N-(2-acetylphenyl)-3-[4-(1-azepanylsulfonyl)phenyl]propanamide
IUPAC Name:N-(2-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide
Traditional Name:N-(2-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=CC=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3


Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3


InChI

InChI=1S/C23H28N2O4S/c1-18(26)21-8-4-5-9-22(21)24-23(27)15-12-19-10-13-20(14-11-19)30(28,29)25-16-6-2-3-7-17-25/h4-5,8-11,13-14H,2-3,6-7,12,15-17H2,1H3,(H,24,27)


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