ethyl 2-[(4-chlorophenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(4-chlorophenyl)methylthio]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chlorophenyl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(4-chlorobenzyl)thio]-4-keto-5-methyl-3-p-anisyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C25H23ClN2O4S2 MolecularWeight: 515.04412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)OC)SCC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC=C(C=C3)OC)SCC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H23ClN2O4S2/c1-4-32-24(30)21-15(2)20-22(34-21)27-25(33-14-17-5-9-18(26)10-6-17)28(23(20)29)13-16-7-11-19(31-3)12-8-16/h5-12H,4,13-14H2,1-3H3