cyclohexyl 3-[2-(4-tert-butylphenoxy)ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 3-[2-(4-tert-butylphenoxy)ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 3-[2-(4-tert-butylphenoxy)ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-(4-tert-butylphenoxy)ethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[2-(4-tert-butylphenoxy)ethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(4-tert-butylphenoxy)ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C26H32N2O4S MolecularWeight: 468.60828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=C(C=C3)C(C)(C)C)C(=O)OC4CCCCC4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCOC3=CC=C(C=C3)C(C)(C)C)C(=O)OC4CCCCC4

InChI

InChI=1S/C26H32N2O4S/c1-17-21-23(33-22(17)25(30)32-20-8-6-5-7-9-20)27-16-28(24(21)29)14-15-31-19-12-10-18(11-13-19)26(2,3)4/h10-13,16,20H,5-9,14-15H2,1-4H3