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

Systemtic Name: methyl 4-(4-fluorophenyl)-2-methylsulfanyl-6-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-6-isopropyl-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(4-fluorophenyl)-2-(methylthio)-6-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-2-methylsulfanyl-6-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 4-(4-fluorophenyl)-6-isopropyl-2-(methylthio)pyrimidine-5-carboxylic acid methyl ester Formula: C16H17FN2O2S MolecularWeight: 320.381783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)SC

Isomeric SMILES

CC(C)C1=NC(=NC(=C1C(=O)OC)C2=CC=C(C=C2)F)SC

InChI

InChI=1S/C16H17FN2O2S/c1-9(2)13-12(15(20)21-3)14(19-16(18-13)22-4)10-5-7-11(17)8-6-10/h5-9H,1-4H3