3-methyl-4-oxidanylidene-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Openeye Name: 3-methyl-4-oxo-2-thioxo-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide CAS Name: 3-methyl-4-oxo-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide IUPAC Name: 3-methyl-4-oxo-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-methyl-2-thioxo-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Formula: C12H10N6O2S MolecularWeight: 302.3118

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=NC=NN3)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3=NC=NN3)NC1=S

InChI

InChI=1S/C12H10N6O2S/c1-18-10(20)7-3-2-6(4-8(7)15-12(18)21)9(19)16-11-13-5-14-17-11/h2-5H,1H3,(H,15,21)(H2,13,14,16,17,19)