ethyl 4-[ethyl(phenyl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[ethyl(phenyl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(N-ethylanilino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(N-ethylanilino)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(N-ethylanilino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(N-ethylanilino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC(=NC=C2C(=O)OCC)SC

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC(=NC=C2C(=O)OCC)SC

InChI

InChI=1S/C16H19N3O2S/c1-4-19(12-9-7-6-8-10-12)14-13(15(20)21-5-2)11-17-16(18-14)22-3/h6-11H,4-5H2,1-3H3