4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-phenyl-3-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-ylpyrazol-4-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-phenyl-3-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)-1H-1,2,4-triazole-5-thione Formula: C21H16N6S MolecularWeight: 384.45694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C=N2)C3=NNC(=S)N3C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C=N2)C3=NNC(=S)N3C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C21H16N6S/c28-21-24-23-19(26(21)16-9-3-1-4-10-16)18-15-22-27(17-11-5-2-6-12-17)20(18)25-13-7-8-14-25/h1-15H,(H,24,28)