[(2S)-4-methylsulfonyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]azanium

Systemtic Name: [(2S)-4-methylsulfonyl-1-oxidanylidene-1-(pyridin-3-ylmethylamino)butan-2-yl]azanium Openeye Name: [(1S)-3-methylsulfonyl-1-(3-pyridylmethylcarbamoyl)propyl]ammonium CAS Name: [(2S)-4-methylsulfonyl-1-oxo-1-(3-pyridinylmethylamino)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfonyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]azanium Traditional Name: [(1S)-3-mesyl-1-(3-pyridylmethylcarbamoyl)propyl]ammonium Formula: C11H18N3O3S+ MolecularWeight: 272.34392

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NCC1=CN=CC=C1)[NH3+]

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C(=O)NCC1=CN=CC=C1)[NH3+]

InChI

InChI=1S/C11H17N3O3S/c1-18(16,17)6-4-10(12)11(15)14-8-9-3-2-5-13-7-9/h2-3,5,7,10H,4,6,8,12H2,1H3,(H,14,15)/p+1/t10-/m0/s1