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

Systemtic Name: ethyl 4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-ethoxy-2-oxo-ethyl)sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[(2-ethoxy-2-oxoethyl)thio]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-2-oxoethyl)sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[(2-ethoxy-2-keto-ethyl)thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CC=C2

InChI

InChI=1S/C18H20N2O4S/c1-4-23-14(21)11-25-17-15(18(22)24-5-2)12(3)19-16(20-17)13-9-7-6-8-10-13/h6-10H,4-5,11H2,1-3H3