N-[5-bromanyl-3-[(1-methylpyridin-1-ium-3-yl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide chloride

Systemtic Name: N-[5-bromanyl-3-[(1-methylpyridin-1-ium-3-yl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide chloride Openeye Name: N-[5-bromo-3-[(1-methylpyridin-1-ium-3-yl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide chloride CAS Name: N-[5-bromo-3-[(1-methyl-3-pyridin-1-iumyl)methoxy]-2-pyrazinyl]-4-methylbenzenesulfonamide chloride IUPAC Name: N-[5-bromo-3-[(1-methylpyridin-1-ium-3-yl)methoxy]pyrazin-2-yl]-4-methylbenzenesulfonamide chloride Traditional Name: N-[5-bromo-3-[(1-methylpyridin-1-ium-3-yl)methoxy]pyrazin-2-yl]-4-methyl-benzenesulfonamide chloride Formula: C18H18BrClN4O3S MolecularWeight: 485.78252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(N=C2OCC3=C[N+](=CC=C3)C)Br.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=C(N=C2OCC3=C[N+](=CC=C3)C)Br.[Cl-]

InChI

InChI=1S/C18H18BrN4O3S.ClH/c1-13-5-7-15(8-6-13)27(24,25)22-17-18(21-16(19)10-20-17)26-12-14-4-3-9-23(2)11-14;/h3-11H,12H2,1-2H3,(H,20,22);1H/q+1;/p-1