(E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-ethanoylphenyl)prop-2-enamide

Systemtic Name: (E)-3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(3-ethanoylphenyl)prop-2-enamide Openeye Name: (E)-N-(3-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enamide CAS Name: (E)-N-(3-acetylphenyl)-3-[4-(1-azepanylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-N-(3-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]prop-2-enamide Traditional Name: (E)-N-(3-acetylphenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]acrylamide Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O4S/c1-18(26)20-7-6-8-21(17-20)24-23(27)14-11-19-9-12-22(13-10-19)30(28,29)25-15-4-2-3-5-16-25/h6-14,17H,2-5,15-16H2,1H3,(H,24,27)/b14-11+