4-[4-(4-fluorophenyl)-1-(3-morpholin-4-ylpropyl)imidazol-1-ium-1-yl]pyrimidin-2-amine

Systemtic Name: 4-[4-(4-fluorophenyl)-1-(3-morpholin-4-ylpropyl)imidazol-1-ium-1-yl]pyrimidin-2-amine Openeye Name: 4-[4-(4-fluorophenyl)-1-(3-morpholinopropyl)imidazol-1-ium-1-yl]pyrimidin-2-amine CAS Name: 4-[4-(4-fluorophenyl)-1-[3-(4-morpholinyl)propyl]-1-imidazol-1-iumyl]-2-pyrimidinamine IUPAC Name: 4-[4-(4-fluorophenyl)-1-(3-morpholin-4-ylpropyl)imidazol-1-ium-1-yl]pyrimidin-2-amine Traditional Name: [4-[4-(4-fluorophenyl)-1-(3-morpholinopropyl)imidazol-1-ium-1-yl]pyrimidin-2-yl]amine Formula: C20H24FN6O+ MolecularWeight: 383.442563

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC[N+]2(C=C(N=C2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)N

Isomeric SMILES

C1COCCN1CCC[N+]2(C=C(N=C2)C3=CC=C(C=C3)F)C4=NC(=NC=C4)N

InChI

InChI=1S/C20H24FN6O/c21-17-4-2-16(3-5-17)18-14-27(15-24-18,19-6-7-23-20(22)25-19)11-1-8-26-9-12-28-13-10-26/h2-7,14-15H,1,8-13H2,(H2,22,23,25)/q+1