3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-(5-quinolinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-quinolin-5-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4-(5-quinolyl)-1H-1,2,4-triazole-5-thione Formula: C20H13ClN6S MolecularWeight: 404.87542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)N3C(=NNC3=S)C4=CC(=NN4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)N3C(=NNC3=S)C4=CC(=NN4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H13ClN6S/c21-13-8-6-12(7-9-13)16-11-17(24-23-16)19-25-26-20(28)27(19)18-5-1-4-15-14(18)3-2-10-22-15/h1-11H,(H,23,24)(H,26,28)