4-(furan-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(trifluoromethyl)pyrimidine

Systemtic Name: 4-(furan-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(trifluoromethyl)pyrimidine Openeye Name: 4-(2-furyl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(trifluoromethyl)pyrimidine CAS Name: 4-(2-furanyl)-2-(4-methyl-1-piperazin-4-iumyl)-6-(trifluoromethyl)pyrimidine IUPAC Name: 4-(furan-2-yl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(trifluoromethyl)pyrimidine Traditional Name: 4-(2-furyl)-2-(4-methylpiperazin-4-ium-1-yl)-6-(trifluoromethyl)pyrimidine Formula: C14H16F3N4O+ MolecularWeight: 313.29825

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CO3

InChI

InChI=1S/C14H15F3N4O/c1-20-4-6-21(7-5-20)13-18-10(11-3-2-8-22-11)9-12(19-13)14(15,16)17/h2-3,8-9H,4-7H2,1H3/p+1