ethyl 4-ethyl-2-oxidanylidene-6-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-ethyl-2-oxidanylidene-6-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-ethyl-2-oxo-6-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-ethyl-2-oxo-6-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-oxo-6-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-ethyl-2-keto-6-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H18N4O3S2 MolecularWeight: 378.46912

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CSC2=NC=NC3=C2C=CS3)C(=O)OCC

Isomeric SMILES

CCC1C(=C(NC(=O)N1)CSC2=NC=NC3=C2C=CS3)C(=O)OCC

InChI

InChI=1S/C16H18N4O3S2/c1-3-10-12(15(21)23-4-2)11(20-16(22)19-10)7-25-14-9-5-6-24-13(9)17-8-18-14/h5-6,8,10H,3-4,7H2,1-2H3,(H2,19,20,22)