ethyl 4-[(3-ethoxycarbonyloxyphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(3-ethoxycarbonyloxyphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(3-ethoxycarbonyloxyanilino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(3-ethoxycarbonyloxyanilino)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-ethoxycarbonyloxyanilino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(3-carbethoxyoxyanilino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)OC(=O)OCC)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)OC(=O)OCC)SC

InChI

InChI=1S/C17H19N3O5S/c1-4-23-15(21)13-10-18-16(26-3)20-14(13)19-11-7-6-8-12(9-11)25-17(22)24-5-2/h6-10H,4-5H2,1-3H3,(H,18,19,20)