3-[(3-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-[(3-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-N-[2-(trifluoromethyl)phenyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-(3-fluorobenzyl)-4-keto-5-methyl-N-[2-(trifluoromethyl)phenyl]thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H15F4N3O2S MolecularWeight: 461.432013

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)F)C(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)F)C(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H15F4N3O2S/c1-12-17-20(27-11-29(21(17)31)10-13-5-4-6-14(23)9-13)32-18(12)19(30)28-16-8-3-2-7-15(16)22(24,25)26/h2-9,11H,10H2,1H3,(H,28,30)