cyclohexyl 5-methyl-4-[(2-propoxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 5-methyl-4-[(2-propoxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 5-methyl-4-(2-propoxyanilino)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-(2-propoxyanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-4-(2-propoxyanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(2-propoxyanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1NC2=C3C(=C(SC3=NC=N2)C(=O)OC4CCCCC4)C

Isomeric SMILES

CCCOC1=CC=CC=C1NC2=C3C(=C(SC3=NC=N2)C(=O)OC4CCCCC4)C

InChI

InChI=1S/C23H27N3O3S/c1-3-13-28-18-12-8-7-11-17(18)26-21-19-15(2)20(30-22(19)25-14-24-21)23(27)29-16-9-5-4-6-10-16/h7-8,11-12,14,16H,3-6,9-10,13H2,1-2H3,(H,24,25,26)