(4-ethanoylphenyl) 4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidine-5-carboxylate

Systemtic Name: (4-ethanoylphenyl) 4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: (4-acetylphenyl) 2-isopropyl-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-(methylthio)-2-propan-2-yl-5-pyrimidinecarboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 4-methyl-6-methylsulfanyl-2-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 2-isopropyl-4-methyl-6-(methylthio)pyrimidine-5-carboxylic acid (4-acetylphenyl) ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SC)C(=O)OC2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SC)C(=O)OC2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C18H20N2O3S/c1-10(2)16-19-11(3)15(17(20-16)24-5)18(22)23-14-8-6-13(7-9-14)12(4)21/h6-10H,1-5H3