6-cyano-5-oxidanylidene-N,1-diphenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide

Systemtic Name: 6-cyano-5-oxidanylidene-N,1-diphenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide Openeye Name: 6-cyano-5-oxo-N,1-diphenyl-7-(2-thienyl)-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide CAS Name: 6-cyano-5-oxo-N,1-diphenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide IUPAC Name: 6-cyano-5-oxo-N,1-diphenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide Traditional Name: 6-cyano-5-keto-N,1-diphenyl-7-(2-thienyl)-[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxamide Formula: C23H14N6O2S MolecularWeight: 438.46126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=NN(C3=NC(=C(C(=O)N23)C#N)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=NN(C3=NC(=C(C(=O)N23)C#N)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C23H14N6O2S/c24-14-17-19(18-12-7-13-32-18)26-23-28(22(17)31)20(21(30)25-15-8-3-1-4-9-15)27-29(23)16-10-5-2-6-11-16/h1-13H,(H,25,30)