4-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(1,3-diphenyl-4-pyrazolyl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(1,3-diphenylpyrazol-4-yl)methylideneamino]-3-pyridin-4-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(1,3-diphenylpyrazol-4-yl)methyleneamino]-3-(4-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C23H17N7S MolecularWeight: 423.49298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NN3C(=NNC3=S)C4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/N3C(=NNC3=S)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H17N7S/c31-23-27-26-22(18-11-13-24-14-12-18)30(23)25-15-19-16-29(20-9-5-2-6-10-20)28-21(19)17-7-3-1-4-8-17/h1-16H,(H,27,31)/b25-15+