ethyl 5-propylidene-7-pyridin-3-yl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-propylidene-7-pyridin-3-yl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-propylidene-7-(3-pyridyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 5-propylidene-7-(3-pyridinyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-propylidene-7-pyridin-3-yl-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 5-propylidene-7-(3-pyridyl)-6,7-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H19N5O2 MolecularWeight: 313.35436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC=C1C(C(N2C(=N1)N=CN2)C3=CN=CC=C3)C(=O)OCC

Isomeric SMILES

CCC=C1C(C(N2C(=N1)N=CN2)C3=CN=CC=C3)C(=O)OCC

InChI

InChI=1S/C16H19N5O2/c1-3-6-12-13(15(22)23-4-2)14(11-7-5-8-17-9-11)21-16(20-12)18-10-19-21/h5-10,13-14H,3-4H2,1-2H3,(H,18,19,20)