[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone Openeye Name: (5-phenyl-1H-pyrazol-4-yl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-(5-phenyl-1H-pyrazol-4-yl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(5-phenyl-1H-pyrazol-4-yl)methanone Traditional Name: (5-phenyl-1H-pyrazol-4-yl)-(4-tosylpiperazino)methanone Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3S/c1-16-7-9-18(10-8-16)29(27,28)25-13-11-24(12-14-25)21(26)19-15-22-23-20(19)17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3,(H,22,23)