[(E)-3-phenylprop-2-enyl] 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: [(E)-cinnamyl] 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid [(E)-cinnamyl] ester Formula: C15H13ClN2O2S MolecularWeight: 320.79392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)OCC=CC2=CC=CC=C2)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)OC/C=C/C2=CC=CC=C2)Cl

InChI

InChI=1S/C15H13ClN2O2S/c1-21-15-17-10-12(16)13(18-15)14(19)20-9-5-8-11-6-3-2-4-7-11/h2-8,10H,9H2,1H3/b8-5+