5-bromanyl-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[3-[4-(3-phenylpropyl)-1-pyridin-1-iumyl]-2-quinoxalinyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[3-[4-(3-phenylpropyl)pyridin-1-ium-1-yl]quinoxalin-2-yl]thiophene-2-sulfonamide Formula: C26H22BrN4O2S2+ MolecularWeight: 566.51248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(S5)Br

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CC=[N+](C=C2)C3=NC4=CC=CC=C4N=C3NS(=O)(=O)C5=CC=C(S5)Br

InChI

InChI=1S/C26H22BrN4O2S2/c27-23-13-14-24(34-23)35(32,33)30-25-26(29-22-12-5-4-11-21(22)28-25)31-17-15-20(16-18-31)10-6-9-19-7-2-1-3-8-19/h1-5,7-8,11-18H,6,9-10H2,(H,28,30)/q+1