N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: 1-mesyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]isonipecotamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

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