[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: (4-methylsulfonylpiperazin-1-yl)-[3-(o-tolyl)-1-phenyl-pyrazol-4-yl]methanone CAS Name: [3-(2-methylphenyl)-1-phenyl-4-pyrazolyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-(2-methylphenyl)-1-phenylpyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-mesylpiperazino)-[3-(o-tolyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C22H24N4O3S MolecularWeight: 424.51596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c1-17-8-6-7-11-19(17)21-20(16-26(23-21)18-9-4-3-5-10-18)22(27)24-12-14-25(15-13-24)30(2,28)29/h3-11,16H,12-15H2,1-2H3