cyclohexyl 5-methyl-4-[(4-piperidin-1-ylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 5-methyl-4-[(4-piperidin-1-ylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 5-methyl-4-[4-(1-piperidyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[4-(1-piperidinyl)anilino]-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-4-(4-piperidin-1-ylanilino)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-(4-piperidinoanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C25H30N4O2S MolecularWeight: 450.5963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N4CCCCC4)C(=O)OC5CCCCC5

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N4CCCCC4)C(=O)OC5CCCCC5

InChI

InChI=1S/C25H30N4O2S/c1-17-21-23(28-18-10-12-19(13-11-18)29-14-6-3-7-15-29)26-16-27-24(21)32-22(17)25(30)31-20-8-4-2-5-9-20/h10-13,16,20H,2-9,14-15H2,1H3,(H,26,27,28)