[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-[4-(4-methylphenyl)piperazin-1-yl]methanethione

Systemtic Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-[4-(4-methylphenyl)piperazin-1-yl]methanethione Openeye Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-[4-(p-tolyl)piperazin-1-yl]methanethione CAS Name: [3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-[4-(4-methylphenyl)-1-piperazinyl]methanethione IUPAC Name: [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-[4-(4-methylphenyl)piperazin-1-yl]methanethione Traditional Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-[4-(p-tolyl)piperazino]methanethione Formula: C28H28N4OS MolecularWeight: 468.61312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)C(=S)C3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)C(=S)C3=CN(N=C3C4=CC=C(C=C4)OC)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4OS/c1-21-8-12-23(13-9-21)30-16-18-31(19-17-30)28(34)26-20-32(24-6-4-3-5-7-24)29-27(26)22-10-14-25(33-2)15-11-22/h3-15,20H,16-19H2,1-2H3