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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-imidazolyl)-6-(trifluoromethyl)-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-imidazol-1-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-imidazol-1-yl-6-(trifluoromethyl)thieno[2,3-d]pyrimidin-4-yl]-piperonyl-amine Formula: C18H12F3N5O2S MolecularWeight: 419.38039

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)N5C=CN=C5)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C4C=C(SC4=NC(=N3)N5C=CN=C5)C(F)(F)F

InChI

InChI=1S/C18H12F3N5O2S/c19-18(20,21)14-6-11-15(23-7-10-1-2-12-13(5-10)28-9-27-12)24-17(25-16(11)29-14)26-4-3-22-8-26/h1-6,8H,7,9H2,(H,23,24,25)