ethyl 6-(acetyloxymethyl)-2-methylsulfanyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(acetyloxymethyl)-2-methylsulfanyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(acetoxymethyl)-2-methylsulfanyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 6-(acetyloxymethyl)-2-(methylthio)-4-[2-(methylthio)phenyl]-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(acetyloxymethyl)-2-methylsulfanyl-4-(2-methylsulfanylphenyl)-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 6-(acetoxymethyl)-2-(methylthio)-4-[2-(methylthio)phenyl]-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=CC=CC=C2SC)SC)COC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=CC=CC=C2SC)SC)COC(=O)C

InChI

InChI=1S/C18H22N2O4S2/c1-5-23-17(22)15-13(10-24-11(2)21)19-18(26-4)20-16(15)12-8-6-7-9-14(12)25-3/h6-9,16H,5,10H2,1-4H3,(H,19,20)