5-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]thiophene-2-sulfonamide Formula: C14H17BrN3O3S2+ MolecularWeight: 419.33708

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C14H16BrN3O3S2/c15-12-2-4-14(22-12)23(19,20)17-10-11-1-3-13(16-9-11)18-5-7-21-8-6-18/h1-4,9,17H,5-8,10H2/p+1