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

Systemtic Name: N'-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine Openeye Name: N'-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine CAS Name: N'-[4-(1-methyl-4-pyrazolyl)-6-(trifluoromethyl)-2-pyrimidinyl]propane-1,3-diamine IUPAC Name: N'-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine Traditional Name: 3-aminopropyl-[4-(1-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C12H15F3N6 MolecularWeight: 300.28291

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15F3N6/c1-21-7-8(6-18-21)9-5-10(12(13,14)15)20-11(19-9)17-4-2-3-16/h5-7H,2-4,16H2,1H3,(H,17,19,20)