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

Systemtic Name: 2-cyclopentylethyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-cyclopentylethyl 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-cyclopentylethyl ester IUPAC Name: 2-cyclopentylethyl 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-cyclopentylethyl ester Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2CCCC2

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2CCCC2

InChI

InChI=1S/C14H22N2O3S/c1-9-12(11(8-17)16-14(20)15-9)13(18)19-7-6-10-4-2-3-5-10/h10-11,17H,2-8H2,1H3,(H2,15,16,20)