ethyl 2-(4-chlorophenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylate CAS Name: 2-(4-chlorophenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-6-methyl-4-sulfanylidene-1H-pyrimidine-5-carboxylate Traditional Name: 2-(4-chlorophenyl)-6-methyl-4-thioxo-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1=S)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1=S)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C14H13ClN2O2S/c1-3-19-14(18)11-8(2)16-12(17-13(11)20)9-4-6-10(15)7-5-9/h4-7H,3H2,1-2H3,(H,16,17,20)