(2S)-6-azanyl-2-[(4-methylphenyl)sulfonylcarbamoylamino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[(4-methylphenyl)sulfonylcarbamoylamino]hexanoic acid Openeye Name: (2S)-6-amino-2-(p-tolylsulfonylcarbamoylamino)hexanoic acid CAS Name: (2S)-6-amino-2-[[[(4-methylphenyl)sulfonylamino]-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[(4-methylphenyl)sulfonylcarbamoylamino]hexanoic acid Traditional Name: (2S)-6-amino-2-(tosylcarbamoylamino)hexanoic acid Formula: C14H21N3O5S MolecularWeight: 343.39864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)N[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C14H21N3O5S/c1-10-5-7-11(8-6-10)23(21,22)17-14(20)16-12(13(18)19)4-2-3-9-15/h5-8,12H,2-4,9,15H2,1H3,(H,18,19)(H2,16,17,20)/t12-/m0/s1