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

Systemtic Name: 2-(4-methylphenyl)ethyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(p-tolyl)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-methylphenyl)ethyl ester IUPAC Name: 2-(4-methylphenyl)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-(p-tolyl)ethyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCOC(=O)C2=C(NC(=S)NC2CO)C

Isomeric SMILES

CC1=CC=C(C=C1)CCOC(=O)C2=C(NC(=S)NC2CO)C

InChI

InChI=1S/C16H20N2O3S/c1-10-3-5-12(6-4-10)7-8-21-15(20)14-11(2)17-16(22)18-13(14)9-19/h3-6,13,19H,7-9H2,1-2H3,(H2,17,18,22)