cyclohexyl 5-methyl-4-oxidanylidene-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 5-methyl-4-oxidanylidene-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 3-[(3-isopropoxycarbonylphenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[[3-[oxo(propan-2-yloxy)methyl]phenyl]methyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-4-oxo-3-[(3-propan-2-yloxycarbonylphenyl)methyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(3-isopropoxycarbonylbenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C25H28N2O5S MolecularWeight: 468.56522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC(=C3)C(=O)OC(C)C)C(=O)OC4CCCCC4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC(=C3)C(=O)OC(C)C)C(=O)OC4CCCCC4

InChI

InChI=1S/C25H28N2O5S/c1-15(2)31-24(29)18-9-7-8-17(12-18)13-27-14-26-22-20(23(27)28)16(3)21(33-22)25(30)32-19-10-5-4-6-11-19/h7-9,12,14-15,19H,4-6,10-11,13H2,1-3H3