N-(1,3-benzodioxol-5-ylmethyl)-2-pyridin-2-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-pyridin-2-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-pyridyl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-pyridinyl)-6-(trifluoromethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-pyridin-2-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: piperonyl-[2-(2-pyridyl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H13F3N4O2S MolecularWeight: 430.40303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)C5=CC=CC=N5)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)C5=CC=CC=N5)C(F)(F)F

InChI

InChI=1S/C20H13F3N4O2S/c21-20(22,23)16-8-12-17(25-9-11-4-5-14-15(7-11)29-10-28-14)26-18(27-19(12)30-16)13-3-1-2-6-24-13/h1-8H,9-10H2,(H,25,26,27)