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

Systemtic Name: 2-methylpropyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 5-methyl-4-oxo-3-[2-oxo-2-(4-phenylphenyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(4-phenylphenyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-methyl-4-oxo-3-[2-oxo-2-(4-phenylphenyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(4-phenylphenyl)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24N2O4S/c1-16(2)14-32-26(31)23-17(3)22-24(33-23)27-15-28(25(22)30)13-21(29)20-11-9-19(10-12-20)18-7-5-4-6-8-18/h4-12,15-16H,13-14H2,1-3H3