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

Systemtic Name: ethyl 4-[(3-methyl-1,2-oxazol-5-yl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[(3-methylisoxazol-5-yl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[(3-methyl-5-isoxazolyl)amino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3-methyl-1,2-oxazol-5-yl)amino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[(3-methylisoxazol-5-yl)amino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C12H14N4O3S MolecularWeight: 294.32956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O3S/c1-4-18-11(17)8-6-13-12(20-3)15-10(8)14-9-5-7(2)16-19-9/h5-6H,4H2,1-3H3,(H,13,14,15)