4-(1,3-benzodioxol-5-yl)-6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-amine

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-amine Openeye Name: 4-(1,3-benzodioxol-5-yl)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-amine CAS Name: 4-(1,3-benzodioxol-5-yl)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-5-pyrimidinamine IUPAC Name: 4-(1,3-benzodioxol-5-yl)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methylpyrimidin-5-amine Traditional Name: [4-(1,3-benzodioxol-5-yl)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-yl]amine Formula: C19H13F4N3O2 MolecularWeight: 391.319033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)C2=C(C=C(C=C2)C(F)(F)F)F)N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=C(C(=N1)C2=C(C=C(C=C2)C(F)(F)F)F)N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H13F4N3O2/c1-9-25-17(10-2-5-14-15(6-10)28-8-27-14)16(24)18(26-9)12-4-3-11(7-13(12)20)19(21,22)23/h2-7H,8,24H2,1H3