[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanethione

Systemtic Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanethione Openeye Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanethione CAS Name: [3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-(4-phenyl-1-piperazinyl)methanethione IUPAC Name: [3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-(4-phenylpiperazin-1-yl)methanethione Traditional Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-phenylpiperazino)methanethione Formula: C26H23ClN4S MolecularWeight: 459.00562

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=S)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=S)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H23ClN4S/c27-21-13-11-20(12-14-21)25-24(19-31(28-25)23-9-5-2-6-10-23)26(32)30-17-15-29(16-18-30)22-7-3-1-4-8-22/h1-14,19H,15-18H2