[(E)-3-phenylprop-2-enyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Openeye Name: [(E)-cinnamyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate CAS Name: 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate Traditional Name: 7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid [(E)-cinnamyl] ester Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NC2=NC=NN12)C(=O)OCC=CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(C=NC2=NC=NN12)C(=O)OC/C=C/C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2/c1-2-15-14(11-18-17-19-12-20-21(15)17)16(22)23-10-6-9-13-7-4-3-5-8-13/h3-9,11-12H,2,10H2,1H3/b9-6+