1-(2,4-dimethylphenyl)sulfonyl-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[[6-(1-pyrazolyl)-3-pyridinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(6-pyrazol-1-ylpyridin-3-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(6-pyrazol-1-yl-3-pyridyl)methyl]isonipecotamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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