N2,N4-bis(4-fluorophenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2,N4-bis(4-fluorophenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1,3,5-triazine-2,4-diamine Openeye Name: N2,N4-bis(4-fluorophenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1,3,5-triazine-2,4-diamine CAS Name: N2,N4-bis(4-fluorophenyl)-6-(4-methyl-1-piperazin-4-iumyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N,4-N-bis(4-fluorophenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-(4-fluoroanilino)-6-(4-methylpiperazin-4-ium-1-yl)-s-triazin-2-yl]-(4-fluorophenyl)amine Formula: C20H22F2N7+ MolecularWeight: 398.432386

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC(=N2)NC3=CC=C(C=C3)F)NC4=CC=C(C=C4)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC(=N2)NC3=CC=C(C=C3)F)NC4=CC=C(C=C4)F

InChI

InChI=1S/C20H21F2N7/c1-28-10-12-29(13-11-28)20-26-18(23-16-6-2-14(21)3-7-16)25-19(27-20)24-17-8-4-15(22)5-9-17/h2-9H,10-13H2,1H3,(H2,23,24,25,26,27)/p+1