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

Systemtic Name: ethyl 4-[(4-methoxycarbonyloxyphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-methoxycarbonyloxyanilino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxycarbonyloxyanilino)-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxycarbonyloxyanilino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(4-carbomethoxyoxyanilino)-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O5S/c1-4-23-14(20)12-9-17-15(25-3)19-13(12)18-10-5-7-11(8-6-10)24-16(21)22-2/h5-9H,4H2,1-3H3,(H,17,18,19)