6-oxidanylidene-3-[[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-1,4-dien-1-olate

Systemtic Name: 6-oxidanylidene-3-[[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-1,4-dien-1-olate Openeye Name: 6-oxo-3-[[[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]cyclohexa-1,4-dien-1-olate CAS Name: 6-oxo-3-[[[3-(2-pyridinyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]amino]methylidene]-1-cyclohexa-1,4-dienolate IUPAC Name: 6-oxo-3-[[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]cyclohexa-1,4-dien-1-olate Traditional Name: 6-keto-3-[[[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]amino]methylene]cyclohexa-1,4-dien-1-olate Formula: C14H10N5O2S- MolecularWeight: 312.3265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NNC(=S)N2NC=C3C=CC(=O)C(=C3)[O-]

Isomeric SMILES

C1=CC=NC(=C1)C2=NNC(=S)N2NC=C3C=CC(=O)C(=C3)[O-]

InChI

InChI=1S/C14H11N5O2S/c20-11-5-4-9(7-12(11)21)8-16-19-13(17-18-14(19)22)10-3-1-2-6-15-10/h1-8,16,21H,(H,18,22)/p-1