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

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]isonipecotamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=NC=C3)N4C=CC=N4)C

InChI

InChI=1S/C23H27N5O3S/c1-17-4-5-21(14-18(17)2)32(30,31)27-12-7-20(8-13-27)23(29)25-16-19-6-10-24-22(15-19)28-11-3-9-26-28/h3-6,9-11,14-15,20H,7-8,12-13,16H2,1-2H3,(H,25,29)