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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[(2-pyrimidinylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(2-pyrimidylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H14N4O3S2 MolecularWeight: 362.42666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CSC3=NC=CC=N3)C

InChI

InChI=1S/C15H14N4O3S2/c1-3-22-14(21)11-8(2)10-12(20)18-9(19-13(10)24-11)7-23-15-16-5-4-6-17-15/h4-6H,3,7H2,1-2H3,(H,18,19,20)