6-methyl-N4-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-3-ium-2,4-diamine

Systemtic Name: 6-methyl-N4-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-3-ium-2,4-diamine Openeye Name: 6-methyl-N4-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-3-ium-2,4-diamine CAS Name: 6-methyl-N4-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-3-ium-2,4-diamine IUPAC Name: 6-methyl-4-N-[[3-(trifluoromethyl)phenyl]methyl]pyrimidin-3-ium-2,4-diamine Traditional Name: (2-amino-6-methyl-pyrimidin-3-ium-4-yl)-[3-(trifluoromethyl)benzyl]amine Formula: C13H14F3N4+ MolecularWeight: 283.27227

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)N)NCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)N)NCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C13H13F3N4/c1-8-5-11(20-12(17)19-8)18-7-9-3-2-4-10(6-9)13(14,15)16/h2-6H,7H2,1H3,(H3,17,18,19,20)/p+1