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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O4S/c1-13(23)14-5-7-16(8-6-14)20-18(24)15-4-3-9-22(10-15)27(25,26)17-11-21(2)12-19-17/h5-8,11-12,15H,3-4,9-10H2,1-2H3,(H,20,24)