ethyl 5-methyl-4-[3-(trifluoromethyl)piperidin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-4-[3-(trifluoromethyl)piperidin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-[3-(trifluoromethyl)-1-piperidyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[3-(trifluoromethyl)-1-piperidinyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-[3-(trifluoromethyl)piperidin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[3-(trifluoromethyl)piperidino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=CN=C2S1)N3CCCC(C3)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=CN=C2S1)N3CCCC(C3)C(F)(F)F)C

InChI

InChI=1S/C16H18F3N3O2S/c1-3-24-15(23)12-9(2)11-13(20-8-21-14(11)25-12)22-6-4-5-10(7-22)16(17,18)19/h8,10H,3-7H2,1-2H3