6-bromanyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline

Systemtic Name: 6-bromanyl-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Openeye Name: 6-bromo-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline CAS Name: 6-bromo-4-(4-methyl-1-piperazin-4-iumyl)-2-(trifluoromethyl)quinazoline IUPAC Name: 6-bromo-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Traditional Name: 6-bromo-4-(4-methylpiperazin-4-ium-1-yl)-2-(trifluoromethyl)quinazoline Formula: C14H15BrF3N4+ MolecularWeight: 376.19491

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC3=C2C=C(C=C3)Br)C(F)(F)F

InChI

InChI=1S/C14H14BrF3N4/c1-21-4-6-22(7-5-21)12-10-8-9(15)2-3-11(10)19-13(20-12)14(16,17)18/h2-3,8H,4-7H2,1H3/p+1