N,N-di(propan-2-yl)-6-[2-(4-sulfamoylphenyl)ethylamino]pyridin-1-ium-3-sulfonamide

Systemtic Name: N,N-di(propan-2-yl)-6-[2-(4-sulfamoylphenyl)ethylamino]pyridin-1-ium-3-sulfonamide Openeye Name: N,N-diisopropyl-6-[2-(4-sulfamoylphenyl)ethylamino]pyridin-1-ium-3-sulfonamide CAS Name: N,N-di(propan-2-yl)-6-[2-(4-sulfamoylphenyl)ethylamino]-3-pyridin-1-iumsulfonamide IUPAC Name: N,N-di(propan-2-yl)-6-[2-(4-sulfamoylphenyl)ethylamino]pyridin-1-ium-3-sulfonamide Traditional Name: N,N-diisopropyl-6-[2-(4-sulfamoylphenyl)ethylamino]pyridin-1-ium-3-sulfonamide Formula: C19H29N4O4S2+ MolecularWeight: 441.58796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)S(=O)(=O)C1=C[NH+]=C(C=C1)NCCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(C)N(C(C)C)S(=O)(=O)C1=C[NH+]=C(C=C1)NCCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C19H28N4O4S2/c1-14(2)23(15(3)4)29(26,27)18-9-10-19(22-13-18)21-12-11-16-5-7-17(8-6-16)28(20,24)25/h5-10,13-15H,11-12H2,1-4H3,(H,21,22)(H2,20,24,25)/p+1