ethyl 7-methyl-1-phenyl-5-thiophen-2-yl-3-thiophen-2-ylcarbonyl-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 7-methyl-1-phenyl-5-thiophen-2-yl-3-thiophen-2-ylcarbonyl-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate Openeye Name: ethyl 7-methyl-1-phenyl-5-(2-thienyl)-3-(thiophene-2-carbonyl)-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate CAS Name: 7-methyl-3-[oxo(thiophen-2-yl)methyl]-1-phenyl-5-thiophen-2-yl-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-1-phenyl-3-(thiophene-2-carbonyl)-5-thiophen-2-yl-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylate Traditional Name: 7-methyl-1-phenyl-3-(2-thenoyl)-5-(2-thienyl)-5H-[1,2,4]triazolo[4,3-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C24H20N4O3S2 MolecularWeight: 476.5706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=NN2C4=CC=CC=C4)C(=O)C5=CC=CS5)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=NN2C4=CC=CC=C4)C(=O)C5=CC=CS5)C

InChI

InChI=1S/C24H20N4O3S2/c1-3-31-23(30)19-15(2)25-24-27(20(19)17-11-7-13-32-17)22(21(29)18-12-8-14-33-18)26-28(24)16-9-5-4-6-10-16/h4-14,20H,3H2,1-2H3