2-(4-methylpiperidin-1-yl)-4-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile

Systemtic Name: 2-(4-methylpiperidin-1-yl)-4-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Openeye Name: 2-(4-methyl-1-piperidyl)-4-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile CAS Name: 2-(4-methyl-1-piperidinyl)-4-(4-methylsulfonylphenyl)-3-pyrazolecarbonitrile IUPAC Name: 2-(4-methylpiperidin-1-yl)-4-(4-methylsulfonylphenyl)pyrazole-3-carbonitrile Traditional Name: 4-(4-mesylphenyl)-2-(4-methylpiperidino)pyrazole-3-carbonitrile Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)N2C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C#N

Isomeric SMILES

CC1CCN(CC1)N2C(=C(C=N2)C3=CC=C(C=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C17H20N4O2S/c1-13-7-9-20(10-8-13)21-17(11-18)16(12-19-21)14-3-5-15(6-4-14)24(2,22)23/h3-6,12-13H,7-10H2,1-2H3