N-(2,1,3-benzoxadiazol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-amine

Systemtic Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-amine Openeye Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-amine CAS Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-3-(4-methyl-1-piperazinyl)-7-(trifluoromethyl)-5-quinoxalinamine IUPAC Name: N-(2,1,3-benzoxadiazol-5-ylmethyl)-3-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)quinoxalin-5-amine Traditional Name: benzofurazan-5-ylmethyl-[3-(4-methylpiperazino)-7-(trifluoromethyl)quinoxalin-5-yl]amine Formula: C21H20F3N7O MolecularWeight: 443.42501

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CN=C3C=C(C=C(C3=N2)NCC4=CC5=NON=C5C=C4)C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)C2=CN=C3C=C(C=C(C3=N2)NCC4=CC5=NON=C5C=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N7O/c1-30-4-6-31(7-5-30)19-12-26-18-10-14(21(22,23)24)9-17(20(18)27-19)25-11-13-2-3-15-16(8-13)29-32-28-15/h2-3,8-10,12,25H,4-7,11H2,1H3