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

Systemtic Name: 2-(5-chloranylthiophen-2-yl)ethyl 4-(hydroxymethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 2-(5-chloro-2-thienyl)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-(5-chloro-2-thiophenyl)ethyl ester IUPAC Name: 2-(5-chlorothiophen-2-yl)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-(5-chloro-2-thienyl)ethyl ester Formula: C13H15ClN2O3S2 MolecularWeight: 346.8528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2=CC=C(S2)Cl

Isomeric SMILES

CC1=C(C(NC(=S)N1)CO)C(=O)OCCC2=CC=C(S2)Cl

InChI

InChI=1S/C13H15ClN2O3S2/c1-7-11(9(6-17)16-13(20)15-7)12(18)19-5-4-8-2-3-10(14)21-8/h2-3,9,17H,4-6H2,1H3,(H2,15,16,20)