(2-chloranyl-4-fluoranyl-phenyl)methyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (2-chloro-4-fluoro-phenyl)methyl 4-(hydroxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (2-chloro-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-fluorophenyl)methyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-methylol-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (2-chloro-4-fluoro-benzyl) ester Formula: C14H14ClFN2O3S MolecularWeight: 344.788963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C14H14ClFN2O3S/c1-7-12(11(5-19)18-14(22)17-7)13(20)21-6-8-2-3-9(16)4-10(8)15/h2-4,11,19H,5-6H2,1H3,(H2,17,18,22)