ethyl 5-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-3-phenethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-3-phenethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]-5-methyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C28H29N3O4S2 MolecularWeight: 535.67756

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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)SCC(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C28H29N3O4S2/c1-3-35-27(34)24-19(2)23-25(37-24)30-28(31(26(23)33)17-15-21-12-8-5-9-13-21)36-18-22(32)29-16-14-20-10-6-4-7-11-20/h4-13H,3,14-18H2,1-2H3,(H,29,32)