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

Systemtic Name: 2-phenoxyethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(phenethylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(phenethylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(phenethylamino)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(phenethylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(phenethylamino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NCCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NCCC3=CC=CC=C3)C(=O)OCCOC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O5S/c1-18-22-24(35-23(18)26(32)34-15-14-33-20-10-6-3-7-11-20)28-17-29(25(22)31)16-21(30)27-13-12-19-8-4-2-5-9-19/h2-11,17H,12-16H2,1H3,(H,27,30)