1-(2,4-dimethylphenyl)sulfonyl-N-(6-imidazol-1-ylpyridin-3-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(6-imidazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(6-imidazol-1-yl-3-pyridyl)piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[6-(1-imidazolyl)-3-pyridinyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(6-imidazol-1-ylpyridin-3-yl)piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-(6-imidazol-1-yl-3-pyridyl)isonipecotamide Formula: C22H25N5O3S MolecularWeight: 439.5306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4)C

InChI

InChI=1S/C22H25N5O3S/c1-16-3-5-20(17(2)13-16)31(29,30)27-10-7-18(8-11-27)22(28)25-19-4-6-21(24-14-19)26-12-9-23-15-26/h3-6,9,12-15,18H,7-8,10-11H2,1-2H3,(H,25,28)