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

Systemtic Name: cyclohexyl 2-(4-chlorophenyl)-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 2-(4-chlorophenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-(4-chlorophenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(4-chlorophenyl)-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-(4-chlorophenyl)-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O3S/c1-11-15-18(24)22-17(12-7-9-13(21)10-8-12)23-19(15)27-16(11)20(25)26-14-5-3-2-4-6-14/h7-10,14H,2-6H2,1H3,(H,22,23,24)