5-oxidanylidene-1-phenyl-7-thiophen-2-yl-3-thiophen-2-ylcarbonyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile

Systemtic Name: 5-oxidanylidene-1-phenyl-7-thiophen-2-yl-3-thiophen-2-ylcarbonyl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Openeye Name: 5-oxo-1-phenyl-7-(2-thienyl)-3-(thiophene-2-carbonyl)-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile CAS Name: 5-oxo-3-[oxo(thiophen-2-yl)methyl]-1-phenyl-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile IUPAC Name: 5-oxo-1-phenyl-3-(thiophene-2-carbonyl)-7-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Traditional Name: 5-keto-1-phenyl-3-(2-thenoyl)-7-(2-thienyl)-[1,2,4]triazolo[4,3-a]pyrimidine-6-carbonitrile Formula: C21H11N5O2S2 MolecularWeight: 429.47434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=NC(=C(C(=O)N3C(=N2)C(=O)C4=CC=CS4)C#N)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)N2C3=NC(=C(C(=O)N3C(=N2)C(=O)C4=CC=CS4)C#N)C5=CC=CS5

InChI

InChI=1S/C21H11N5O2S2/c22-12-14-17(15-8-4-10-29-15)23-21-25(20(14)28)19(18(27)16-9-5-11-30-16)24-26(21)13-6-2-1-3-7-13/h1-11H