4-butyl-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate

Systemtic Name: 4-butyl-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Openeye Name: 4-butyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate CAS Name: 4-butyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate IUPAC Name: 4-butyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Traditional Name: 4-butyl-5-keto-[1,2,4]triazolo[4,3-a]quinazoline-1-thiolate Formula: C13H13N4OS- MolecularWeight: 273.33352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3[S-]

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3[S-]

InChI

InChI=1S/C13H14N4OS/c1-2-3-8-16-11(18)9-6-4-5-7-10(9)17-12(16)14-15-13(17)19/h4-7H,2-3,8H2,1H3,(H,15,19)/p-1