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

Systemtic Name: 5-methyl-4-[[2-(trifluoromethyl)phenyl]amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-[2-(trifluoromethyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-[2-(trifluoromethyl)anilino]-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-4-[2-(trifluoromethyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-methyl-4-[2-(trifluoromethyl)anilino]thieno[2,3-d]pyrimidine-6-carboxylate Formula: C15H9F3N3O2S- MolecularWeight: 352.31107

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3C(F)(F)F)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3C(F)(F)F)C(=O)[O-]

InChI

InChI=1S/C15H10F3N3O2S/c1-7-10-12(19-6-20-13(10)24-11(7)14(22)23)21-9-5-3-2-4-8(9)15(16,17)18/h2-6H,1H3,(H,22,23)(H,19,20,21)/p-1