ethyl 4-[(3,4-dimethyl-1,2-oxazol-5-yl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(3,4-dimethyl-1,2-oxazol-5-yl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(3,4-dimethylisoxazol-5-yl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[(3,4-dimethyl-5-isoxazolyl)amino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3,4-dimethyl-1,2-oxazol-5-yl)amino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[(3,4-dimethylisoxazol-5-yl)amino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=C(C(=NO2)C)C)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=C(C(=NO2)C)C)SC

InChI

InChI=1S/C13H16N4O3S/c1-5-19-12(18)9-6-14-13(21-4)16-10(9)15-11-7(2)8(3)17-20-11/h6H,5H2,1-4H3,(H,14,15,16)