(4-dimethylaminophenyl)-[4-(1,3-diphenylpyrazol-4-yl)carbothioylpiperazin-1-yl]methanethione

Systemtic Name: (4-dimethylaminophenyl)-[4-(1,3-diphenylpyrazol-4-yl)carbothioylpiperazin-1-yl]methanethione Openeye Name: (4-dimethylaminophenyl)-[4-(1,3-diphenylpyrazole-4-carbothioyl)piperazin-1-yl]methanethione CAS Name: (4-dimethylaminophenyl)-[4-[(1,3-diphenyl-4-pyrazolyl)-sulfanylidenemethyl]-1-piperazinyl]methanethione IUPAC Name: (4-dimethylaminophenyl)-[4-(1,3-diphenylpyrazole-4-carbothioyl)piperazin-1-yl]methanethione Traditional Name: (4-dimethylaminophenyl)-[4-(1,3-diphenylpyrazole-4-carbothioyl)piperazino]methanethione Formula: C29H29N5S2 MolecularWeight: 511.70406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29N5S2/c1-31(2)24-15-13-23(14-16-24)28(35)32-17-19-33(20-18-32)29(36)26-21-34(25-11-7-4-8-12-25)30-27(26)22-9-5-3-6-10-22/h3-16,21H,17-20H2,1-2H3