ethyl 4-(4-methoxyphenyl)-2-oxidanylidene-6-(propan-2-yloxycarbothioylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-oxidanylidene-6-(propan-2-yloxycarbothioylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(isopropoxycarbothioylsulfanylmethyl)-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-oxo-6-[[[propan-2-yloxy(sulfanylidene)methyl]thio]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-oxo-6-(propan-2-yloxycarbothioylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(isopropoxycarbothioylthio)methyl]-2-keto-4-(4-methoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H24N2O5S2 MolecularWeight: 424.53426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CSC(=S)OC(C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CSC(=S)OC(C)C

InChI

InChI=1S/C19H24N2O5S2/c1-5-25-17(22)15-14(10-28-19(27)26-11(2)3)20-18(23)21-16(15)12-6-8-13(24-4)9-7-12/h6-9,11,16H,5,10H2,1-4H3,(H2,20,21,23)