ethyl 5-methyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-(p-tolylmethylsulfanyl)-3-(tetrahydrofuran-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[(4-methylphenyl)methylthio]-4-oxo-3-(2-oxolanylmethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxo-3-(oxolan-2-ylmethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(4-methylbenzyl)thio]-3-(tetrahydrofurfuryl)thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3CCCO3)SCC4=CC=C(C=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3CCCO3)SCC4=CC=C(C=C4)C)C

InChI

InChI=1S/C23H26N2O4S2/c1-4-28-22(27)19-15(3)18-20(31-19)24-23(30-13-16-9-7-14(2)8-10-16)25(21(18)26)12-17-6-5-11-29-17/h7-10,17H,4-6,11-13H2,1-3H3