ethyl 4-[(4-ethanoylphenyl)amino]-6-methyl-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-ethanoylphenyl)amino]-6-methyl-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-acetylanilino)-6-methyl-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(4-acetylanilino)-6-methyl-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-acetylanilino)-6-methyl-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(4-acetylanilino)-6-methyl-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O3S/c1-5-23-16(22)14-10(2)18-17(24-4)20-15(14)19-13-8-6-12(7-9-13)11(3)21/h6-9H,5H2,1-4H3,(H,18,19,20)