[(2S)-4-methylsulfonyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfonyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfonyl-1-[2-(2-pyridyl)ethylcarbamoyl]propyl]ammonium CAS Name: [(2S)-4-methylsulfonyl-1-oxo-1-[2-(2-pyridinyl)ethylamino]butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfonyl-1-oxo-1-(2-pyridin-2-ylethylamino)butan-2-yl]azanium Traditional Name: [(1S)-3-mesyl-1-[2-(2-pyridyl)ethylcarbamoyl]propyl]ammonium Formula: C12H20N3O3S+ MolecularWeight: 286.3705

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NCCC1=CC=CC=N1)[NH3+]

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)NCCC1=CC=CC=N1)[NH3+]

InChI

InChI=1S/C12H19N3O3S/c1-19(17,18)9-6-11(13)12(16)15-8-5-10-4-2-3-7-14-10/h2-4,7,11H,5-6,8-9,13H2,1H3,(H,15,16)/p+1/t11-/m0/s1