N-(3-ethanoylphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-(3-acetylphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(3-acetylphenyl)-1-[(1-methyl-4-imidazolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-1-(1-methylimidazol-4-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-(3-acetylphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-nipecotamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN(C=N3)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN(C=N3)C

InChI

InChI=1S/C18H22N4O4S/c1-13(23)14-5-3-7-16(9-14)20-18(24)15-6-4-8-22(10-15)27(25,26)17-11-21(2)12-19-17/h3,5,7,9,11-12,15H,4,6,8,10H2,1-2H3,(H,20,24)