ethyl 2,5-dimethyl-4-oxidanylidene-3-[2-oxidanyl-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-oxidanylidene-3-[2-oxidanyl-3-(4-phenylphenoxy)propyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[2-hydroxy-3-(4-phenylphenoxy)propyl]-2,5-dimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-hydroxy-3-(4-phenylphenoxy)propyl]-2,5-dimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-hydroxy-3-(4-phenylphenoxy)propyl]-2,5-dimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-hydroxy-3-(4-phenylphenoxy)propyl]-4-keto-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O)C)C

InChI

InChI=1S/C26H26N2O5S/c1-4-32-26(31)23-16(2)22-24(34-23)27-17(3)28(25(22)30)14-20(29)15-33-21-12-10-19(11-13-21)18-8-6-5-7-9-18/h5-13,20,29H,4,14-15H2,1-3H3