[1-[4-(1-ethyl-3-methyl-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]azanium

Systemtic Name: [1-[4-(1-ethyl-3-methyl-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]azanium Openeye Name: [1-[4-(1-ethyl-3-methyl-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-piperidyl]ammonium CAS Name: [1-[4-(1-ethyl-3-methyl-4-pyrazolyl)-6-(trifluoromethyl)-2-pyrimidinyl]-4-piperidinyl]ammonium IUPAC Name: [1-[4-(1-ethyl-3-methylpyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]piperidin-4-yl]azanium Traditional Name: [1-[4-(1-ethyl-3-methyl-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]-4-piperidyl]ammonium Formula: C16H22F3N6+ MolecularWeight: 355.38129

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=CC(=NC(=N2)N3CCC(CC3)[NH3+])C(F)(F)F

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=CC(=NC(=N2)N3CCC(CC3)[NH3+])C(F)(F)F

InChI

InChI=1S/C16H21F3N6/c1-3-25-9-12(10(2)23-25)13-8-14(16(17,18)19)22-15(21-13)24-6-4-11(20)5-7-24/h8-9,11H,3-7,20H2,1-2H3/p+1