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

Systemtic Name: N-butan-2-yl-4-(2-methylpropyl)-5-oxidanylidene-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Openeye Name: 4-isobutyl-5-oxo-N-sec-butyl-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide CAS Name: N-butan-2-yl-4-(2-methylpropyl)-5-oxo-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide IUPAC Name: N-butan-2-yl-4-(2-methylpropyl)-5-oxo-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Traditional Name: 4-isobutyl-5-keto-N-sec-butyl-1-thioxo-2H-[1,2,4]triazolo[4,3-a]quinazoline-8-carboxamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C3=NNC(=S)N23)CC(C)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C3=NNC(=S)N23)CC(C)C

InChI

InChI=1S/C18H23N5O2S/c1-5-11(4)19-15(24)12-6-7-13-14(8-12)23-17(20-21-18(23)26)22(16(13)25)9-10(2)3/h6-8,10-11H,5,9H2,1-4H3,(H,19,24)(H,21,26)