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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(N=CC=C3)N4C=CC=N4)C

InChI

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