4-methyl-2-propan-2-yl-6-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]pyrimidine

Systemtic Name: 4-methyl-2-propan-2-yl-6-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]pyrimidine Openeye Name: 2-isopropyl-4-methyl-6-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]pyrimidine CAS Name: 4-methyl-2-propan-2-yl-6-[4-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-1-piperazinyl]pyrimidine IUPAC Name: 4-methyl-2-propan-2-yl-6-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazin-1-yl]pyrimidine Traditional Name: 2-isopropyl-4-methyl-6-[4-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperazino]pyrimidine Formula: C18H23F3N5+ MolecularWeight: 366.40393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H22F3N5/c1-12(2)17-23-13(3)10-16(24-17)26-8-6-25(7-9-26)15-5-4-14(11-22-15)18(19,20)21/h4-5,10-12H,6-9H2,1-3H3/p+1