[3-(4-methylphenyl)-1H-pyrazol-5-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: (4-methylsulfonylpiperazin-1-yl)-[3-(p-tolyl)-1H-pyrazol-5-yl]methanone CAS Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-(4-methylphenyl)-1H-pyrazol-5-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-mesylpiperazino)-[3-(p-tolyl)-1H-pyrazol-5-yl]methanone Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C16H20N4O3S/c1-12-3-5-13(6-4-12)14-11-15(18-17-14)16(21)19-7-9-20(10-8-19)24(2,22)23/h3-6,11H,7-10H2,1-2H3,(H,17,18)