4-oxidanylidene-N-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide

Systemtic Name: 4-oxidanylidene-N-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide Openeye Name: 4-oxo-N-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide CAS Name: 4-oxo-N-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide IUPAC Name: 4-oxo-N-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)-1H-quinazoline-2-carbothioamide Formula: C11H8N6OS2 MolecularWeight: 304.35082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC(=S)NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC(=S)NN3

InChI

InChI=1S/C11H8N6OS2/c18-8-5-3-1-2-4-6(5)12-7(13-8)9(19)14-10-15-11(20)17-16-10/h1-4H,(H,12,13,18)(H3,14,15,16,17,19,20)