ethyl 4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-methoxy-2-oxo-ethyl)sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[(2-methoxy-2-oxoethyl)thio]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-methoxy-2-oxoethyl)sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[(2-keto-2-methoxy-ethyl)thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SCC(=O)OC)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SCC(=O)OC)C2=CC=CC=C2)C

InChI

InChI=1S/C17H18N2O4S/c1-4-23-17(21)14-11(2)18-15(12-8-6-5-7-9-12)19-16(14)24-10-13(20)22-3/h5-9H,4,10H2,1-3H3