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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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