N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]ethanamide Openeye Name: N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]acetamide CAS Name: N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl]acetamide Traditional Name: N-(2-cyanophenyl)-2-[[4-(4-ethylphenyl)-5-keto-[1,2,4]triazolo[4,3-a]quinazolin-1-yl]thio]acetamide Formula: C26H20N6O2S MolecularWeight: 480.541

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC(=O)NC5=CC=CC=C5C#N

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NN=C4SCC(=O)NC5=CC=CC=C5C#N

InChI

InChI=1S/C26H20N6O2S/c1-2-17-11-13-19(14-12-17)31-24(34)20-8-4-6-10-22(20)32-25(31)29-30-26(32)35-16-23(33)28-21-9-5-3-7-18(21)15-27/h3-14H,2,16H2,1H3,(H,28,33)