N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(1-methyl-2-imidazolyl)-phenylmethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(1-methylimidazol-2-yl)-phenylmethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[(1-methylimidazol-2-yl)-phenyl-methyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H25N5O3S/c1-26-15-12-24-21(26)20(17-6-3-2-4-7-17)25-22(28)18-9-13-27(14-10-18)31(29,30)19-8-5-11-23-16-19/h2-8,11-12,15-16,18,20H,9-10,13-14H2,1H3,(H,25,28)