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

Systemtic Name: 4-(1,3-benzodioxol-5-yloxy)-6-[2-fluoranyl-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-amine Openeye Name: 4-(1,3-benzodioxol-5-yloxy)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-amine CAS Name: 4-(1,3-benzodioxol-5-yloxy)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-5-pyrimidinamine IUPAC Name: 4-(1,3-benzodioxol-5-yloxy)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methylpyrimidin-5-amine Traditional Name: [4-(1,3-benzodioxol-5-yloxy)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyl-pyrimidin-5-yl]amine Formula: C19H13F4N3O3 MolecularWeight: 407.318433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=N1)OC2=CC3=C(C=C2)OCO3)N)C4=C(C=C(C=C4)C(F)(F)F)F

Isomeric SMILES

CC1=NC(=C(C(=N1)OC2=CC3=C(C=C2)OCO3)N)C4=C(C=C(C=C4)C(F)(F)F)F

InChI

InChI=1S/C19H13F4N3O3/c1-9-25-17(12-4-2-10(6-13(12)20)19(21,22)23)16(24)18(26-9)29-11-3-5-14-15(7-11)28-8-27-14/h2-7H,8,24H2,1H3