N-(4-cyano-2-methyl-pyrazol-3-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-1-tosyl-isonipecotamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=NN3C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=NN3C)C#N

InChI

InChI=1S/C18H21N5O3S/c1-13-3-5-16(6-4-13)27(25,26)23-9-7-14(8-10-23)18(24)21-17-15(11-19)12-20-22(17)2/h3-6,12,14H,7-10H2,1-2H3,(H,21,24)