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

Systemtic Name: ethyl 4-(5-chloranyl-2-ethoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(5-chloro-2-ethoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-chloro-2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-chloro-2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(5-chloro-2-ethoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H19ClN2O3S MolecularWeight: 354.85166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C2C(=C(NC(=S)N2)C)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C2C(=C(NC(=S)N2)C)C(=O)OCC

InChI

InChI=1S/C16H19ClN2O3S/c1-4-21-12-7-6-10(17)8-11(12)14-13(15(20)22-5-2)9(3)18-16(23)19-14/h6-8,14H,4-5H2,1-3H3,(H2,18,19,23)