N-cyclopentyl-4-(2-methylpropyl)-5-oxidanylidene-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide

Systemtic Name: N-cyclopentyl-4-(2-methylpropyl)-5-oxidanylidene-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Openeye Name: N-cyclopentyl-4-isobutyl-5-oxo-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide CAS Name: N-cyclopentyl-4-(2-methylpropyl)-5-oxo-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide IUPAC Name: N-cyclopentyl-4-(2-methylpropyl)-5-oxo-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Traditional Name: N-cyclopentyl-4-isobutyl-5-keto-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N4C1=NNC4=S

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCC3)N4C1=NNC4=S

InChI

InChI=1S/C19H23N5O2S/c1-11(2)10-23-17(26)14-8-7-12(16(25)20-13-5-3-4-6-13)9-15(14)24-18(23)21-22-19(24)27/h7-9,11,13H,3-6,10H2,1-2H3,(H,20,25)(H,22,27)