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

Systemtic Name: (5-bromanylthiophen-2-yl)sulfonyl-[3-[4-(phenylmethyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]azanide Openeye Name: [3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-[(5-bromo-2-thienyl)sulfonyl]azanide CAS Name: (5-bromo-2-thiophenyl)sulfonyl-[3-[4-(phenylmethyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]azanide IUPAC Name: [3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-(5-bromothiophen-2-yl)sulfonylazanide Traditional Name: [3-(4-benzylpyridin-1-ium-1-yl)quinoxalin-2-yl]-[(5-bromo-2-thienyl)sulfonyl]azanide Formula: C24H17BrN4O2S2 MolecularWeight: 537.45138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3[N-]S(=O)(=O)C5=CC=C(S5)Br

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3[N-]S(=O)(=O)C5=CC=C(S5)Br

InChI

InChI=1S/C24H17BrN4O2S2/c25-21-10-11-22(32-21)33(30,31)28-23-24(27-20-9-5-4-8-19(20)26-23)29-14-12-18(13-15-29)16-17-6-2-1-3-7-17/h1-15H,16H2