phenethyl 5-methyl-4-oxidanylidene-3-[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-oxidanylidene-3-[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 5-methyl-3-[1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 5-methyl-4-oxo-3-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-1-methyl-2-(4-phenoxyanilino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C31H27N3O5S MolecularWeight: 553.62818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)C(C)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C31H27N3O5S/c1-20-26-29(40-27(20)31(37)38-18-17-22-9-5-3-6-10-22)32-19-34(30(26)36)21(2)28(35)33-23-13-15-25(16-14-23)39-24-11-7-4-8-12-24/h3-16,19,21H,17-18H2,1-2H3,(H,33,35)