ethyl 2-azanyl-4-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-amino-4-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-amino-4-[4-(trifluoromethyl)phenyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-amino-4-[4-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H12F3N3O2S MolecularWeight: 367.34559

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S/c1-2-24-14(23)11-7-10-12(21-15(20)22-13(10)25-11)8-3-5-9(6-4-8)16(17,18)19/h3-7H,2H2,1H3,(H2,20,21,22)