methyl (4R)-6-(4-chlorophenyl)-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-6-(4-chlorophenyl)-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-6-(4-chlorophenyl)-4-(4-methylsulfanylphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-(4-chlorophenyl)-4-[4-(methylthio)phenyl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-6-(4-chlorophenyl)-4-(4-methylsulfanylphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-(4-chlorophenyl)-4-[4-(methylthio)phenyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C19H17ClN2O2S2 MolecularWeight: 404.93348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)SC)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(NC(=S)N[C@@H]1C2=CC=C(C=C2)SC)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O2S2/c1-24-18(23)15-16(11-3-7-13(20)8-4-11)21-19(25)22-17(15)12-5-9-14(26-2)10-6-12/h3-10,17H,1-2H3,(H2,21,22,25)/t17-/m1/s1