[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-(1-pyrazolyl)phenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Traditional Name: (4-pyrazol-1-ylphenyl)-(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=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

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