ethyl 2-(4-chlorophenyl)-3-cyclohexyl-5-methyl-4-oxidanylidene-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylate

Systemtic Name: ethyl 2-(4-chlorophenyl)-3-cyclohexyl-5-methyl-4-oxidanylidene-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylate Openeye Name: ethyl 2-(4-chlorophenyl)-3-cyclohexyl-5-methyl-4-oxo-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylate CAS Name: 2-(4-chlorophenyl)-3-cyclohexyl-5-methyl-4-oxo-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorophenyl)-3-cyclohexyl-5-methyl-4-oxo-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylate Traditional Name: 2-(4-chlorophenyl)-3-cyclohexyl-4-keto-5-methyl-1,2-dihydrothieno[3,4-d]pyrimidine-7-carboxylic acid ethyl ester Formula: C22H25ClN2O3S MolecularWeight: 432.9635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=C(S1)C)C(=O)N(C(N2)C3=CC=C(C=C3)Cl)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C2C(=C(S1)C)C(=O)N(C(N2)C3=CC=C(C=C3)Cl)C4CCCCC4

InChI

InChI=1S/C22H25ClN2O3S/c1-3-28-22(27)19-18-17(13(2)29-19)21(26)25(16-7-5-4-6-8-16)20(24-18)14-9-11-15(23)12-10-14/h9-12,16,20,24H,3-8H2,1-2H3