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

Systemtic Name: cyclohexyl 2-[(4-methoxyphenyl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 2-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[(4-methoxyphenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-p-anisyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4S/c1-13-18-20(25)23-17(12-14-8-10-15(27-2)11-9-14)24-21(18)29-19(13)22(26)28-16-6-4-3-5-7-16/h8-11,16H,3-7,12H2,1-2H3,(H,23,24,25)