4-(4-ethylphenyl)-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate

Systemtic Name: 4-(4-ethylphenyl)-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Openeye Name: 4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate CAS Name: 4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate IUPAC Name: 4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Traditional Name: 4-(4-ethylphenyl)-5-keto-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Formula: C17H13N4OS- MolecularWeight: 321.37632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4[S-]

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4[S-]

InChI

InChI=1S/C17H14N4OS/c1-2-11-7-9-12(10-8-11)20-15(22)13-5-3-4-6-14(13)21-16(20)18-19-17(21)23/h3-10H,2H2,1H3,(H,19,23)/p-1