ethyl 4-(chloromethyl)-3-methyl-2-oxidanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(chloromethyl)-3-methyl-2-oxidanylidene-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(chloromethyl)-3-methyl-2-oxo-6-(2-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-(chloromethyl)-3-methyl-2-oxo-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(chloromethyl)-3-methyl-2-oxo-6-thiophen-2-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 4-(chloromethyl)-2-keto-3-methyl-6-(2-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CS2)C)CCl

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CS2)C)CCl

InChI

InChI=1S/C13H15ClN2O3S/c1-3-19-12(17)10-8(7-14)16(2)13(18)15-11(10)9-5-4-6-20-9/h4-6,11H,3,7H2,1-2H3,(H,15,18)