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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-methylimidazol-1-yl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-methylimidazol-1-yl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-methyl-1-imidazolyl)-6-(trifluoromethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(2-methylimidazol-1-yl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: homopiperonyl-[2-(2-methylimidazol-1-yl)-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H16F3N5O2S MolecularWeight: 447.43355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)C(F)(F)F)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC=CN1C2=NC(=C3C=C(SC3=N2)C(F)(F)F)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H16F3N5O2S/c1-11-24-6-7-28(11)19-26-17(13-9-16(20(21,22)23)31-18(13)27-19)25-5-4-12-2-3-14-15(8-12)30-10-29-14/h2-3,6-9H,4-5,10H2,1H3,(H,25,26,27)