ethyl 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-methyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-methyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-5-methyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-5-methyl-4-oxo-3-phenethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-5-methyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-4-keto-5-methyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C28H28N2O5S2 MolecularWeight: 536.66232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC4=C(C=CC(=C4)C(=O)C)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC4=C(C=CC(=C4)C(=O)C)OC)C

InChI

InChI=1S/C28H28N2O5S2/c1-5-35-27(33)24-17(2)23-25(37-24)29-28(30(26(23)32)14-13-19-9-7-6-8-10-19)36-16-21-15-20(18(3)31)11-12-22(21)34-4/h6-12,15H,5,13-14,16H2,1-4H3