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

Systemtic Name: 2-(4-methylsulfanylphenyl)ethyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(4-methylsulfanylphenyl)ethyl 4-(hydroxymethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-[4-(methylthio)phenyl]ethyl ester IUPAC Name: 2-(4-methylsulfanylphenyl)ethyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-4-methylol-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2-[4-(methylthio)phenyl]ethyl ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2=CC=C(C=C2)SC

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2=CC=C(C=C2)SC

InChI

InChI=1S/C16H20N2O3S2/c1-10-14(13(9-19)18-16(22)17-10)15(20)21-8-7-11-3-5-12(23-2)6-4-11/h3-6,13,19H,7-9H2,1-2H3,(H2,17,18,22)