(5-bromanylthiophen-2-yl)sulfonyl-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]azanide

Systemtic Name: (5-bromanylthiophen-2-yl)sulfonyl-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]azanide Openeye Name: (5-bromo-2-thienyl)sulfonyl-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]azanide CAS Name: (5-bromo-2-thiophenyl)sulfonyl-[3-(4-methyl-1-piperazin-4-iumyl)-2-quinoxalinyl]azanide IUPAC Name: (5-bromothiophen-2-yl)sulfonyl-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]azanide Traditional Name: (5-bromo-2-thienyl)sulfonyl-[3-(4-methylpiperazin-4-ium-1-yl)quinoxalin-2-yl]azanide Formula: C17H18BrN5O2S2 MolecularWeight: 468.39112

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3N=C2[N-]S(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C17H17BrN5O2S2/c1-22-8-10-23(11-9-22)17-16(19-12-4-2-3-5-13(12)20-17)21-27(24,25)15-7-6-14(18)26-15/h2-7H,8-11H2,1H3/q-1/p+1