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

Systemtic Name: 4-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(1-methyl-2-pyrrolyl)methylideneamino]-3-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C13H12N6S MolecularWeight: 284.33958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=NN2C(=NNC2=S)C3=CN=CC=C3

Isomeric SMILES

CN1C=CC=C1/C=N/N2C(=NNC2=S)C3=CN=CC=C3

InChI

InChI=1S/C13H12N6S/c1-18-7-3-5-11(18)9-15-19-12(16-17-13(19)20)10-4-2-6-14-8-10/h2-9H,1H3,(H,17,20)/b15-9+