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

Systemtic Name: [3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Openeye Name: [3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone CAS Name: [3-(2-methoxyphenyl)-1-phenyl-4-pyrazolyl]-(4-methylsulfonyl-1-piperazinyl)methanone IUPAC Name: [3-(2-methoxyphenyl)-1-phenylpyrazol-4-yl]-(4-methylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-mesylpiperazino)-[3-(2-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O4S/c1-30-20-11-7-6-10-18(20)21-19(16-26(23-21)17-8-4-3-5-9-17)22(27)24-12-14-25(15-13-24)31(2,28)29/h3-11,16H,12-15H2,1-2H3