N,N-diethyl-6-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]pyridine-3-sulfonamide

Systemtic Name: N,N-diethyl-6-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]pyridine-3-sulfonamide Openeye Name: N,N-diethyl-6-[(6-morpholinopyridin-1-ium-3-yl)methylamino]pyridine-3-sulfonamide CAS Name: N,N-diethyl-6-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methylamino]-3-pyridinesulfonamide IUPAC Name: N,N-diethyl-6-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methylamino]pyridine-3-sulfonamide Traditional Name: N,N-diethyl-6-[(6-morpholinopyridin-1-ium-3-yl)methylamino]pyridine-3-sulfonamide Formula: C19H28N5O3S+ MolecularWeight: 406.52232

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)NCC2=C[NH+]=C(C=C2)N3CCOCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)NCC2=C[NH+]=C(C=C2)N3CCOCC3

InChI

InChI=1S/C19H27N5O3S/c1-3-24(4-2)28(25,26)17-6-7-18(21-15-17)20-13-16-5-8-19(22-14-16)23-9-11-27-12-10-23/h5-8,14-15H,3-4,9-13H2,1-2H3,(H,20,21)/p+1