N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[2-(2-pyridyl)ethyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-1-ium-2-amine CAS Name: N-[2-(2-pyridinyl)ethyl]-5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-(2-pyridin-2-ylethyl)-5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-amine Traditional Name: 2-(2-pyridyl)ethyl-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)amine Formula: C16H21N4O2S+ MolecularWeight: 333.42854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CC=CC=N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)NCCC3=CC=CC=N3

InChI

InChI=1S/C16H20N4O2S/c21-23(22,20-11-3-4-12-20)15-6-7-16(19-13-15)18-10-8-14-5-1-2-9-17-14/h1-2,5-7,9,13H,3-4,8,10-12H2,(H,18,19)/p+1