[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl] 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid [2-(2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl] 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid [2-(2-ethylanilino)-2-keto-ethyl] ester Formula: C16H16ClN3O3S MolecularWeight: 365.83454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)COC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)COC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C16H16ClN3O3S/c1-3-10-6-4-5-7-12(10)19-13(21)9-23-15(22)14-11(17)8-18-16(20-14)24-2/h4-8H,3,9H2,1-2H3,(H,19,21)