N'-[4-(1-methylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]ethane-1,2-diamine

Systemtic Name: N'-[4-(1-methylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]ethane-1,2-diamine Openeye Name: N'-[4-(1-methylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]ethane-1,2-diamine CAS Name: N'-[4-(1-methyl-3-pyrazolyl)-6-(trifluoromethyl)-2-pyrimidinyl]ethane-1,2-diamine IUPAC Name: N'-[4-(1-methylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-[4-(1-methylpyrazol-3-yl)-6-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C11H13F3N6 MolecularWeight: 286.25633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C2=CC(=NC(=N2)NCCN)C(F)(F)F

Isomeric SMILES

CN1C=CC(=N1)C2=CC(=NC(=N2)NCCN)C(F)(F)F

InChI

InChI=1S/C11H13F3N6/c1-20-5-2-7(19-20)8-6-9(11(12,13)14)18-10(17-8)16-4-3-15/h2,5-6H,3-4,15H2,1H3,(H,16,17,18)