ethyl 5-(4-methoxyphenyl)carbonyloxy-4-oxidanylidene-1,3-diphenyl-2-sulfanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-(4-methoxyphenyl)carbonyloxy-4-oxidanylidene-1,3-diphenyl-2-sulfanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-methoxybenzoyl)oxy-4-oxo-1,3-diphenyl-2-thioxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-[(4-methoxyphenyl)-oxomethoxy]-4-oxo-1,3-diphenyl-2-sulfanylidene-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methoxybenzoyl)oxy-4-oxo-1,3-diphenyl-2-sulfanylidenethieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-p-anisoyloxy-1,3-diphenyl-2-thioxo-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C29H22N2O6S2 MolecularWeight: 558.62478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H22N2O6S2/c1-3-36-28(34)24-23(37-27(33)18-14-16-21(35-2)17-15-18)22-25(32)30(19-10-6-4-7-11-19)29(38)31(26(22)39-24)20-12-8-5-9-13-20/h4-17H,3H2,1-2H3