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

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Openeye Name: 3-isobutyl-4-oxo-2-thioxo-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2-methylpropyl)-4-oxo-2-sulfanylidene-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Traditional Name: 3-isobutyl-4-keto-2-thioxo-N-(1H-1,2,4-triazol-5-yl)-1H-quinazoline-7-carboxamide Formula: C15H16N6O2S MolecularWeight: 344.39154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N6O2S/c1-8(2)6-21-13(23)10-4-3-9(5-11(10)18-15(21)24)12(22)19-14-16-7-17-20-14/h3-5,7-8H,6H2,1-2H3,(H,18,24)(H2,16,17,19,20,22)