(2S)-6-azanyl-2-[1-(phenylsulfanylamino)ethylideneamino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[1-(phenylsulfanylamino)ethylideneamino]hexanoic acid Openeye Name: (2S)-6-amino-2-[1-(phenylsulfanylamino)ethylideneamino]hexanoic acid CAS Name: (2S)-6-amino-2-[1-[(phenylthio)amino]ethylideneamino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[1-(phenylsulfanylamino)ethylideneamino]hexanoic acid Traditional Name: (2S)-6-amino-2-[1-[(phenylthio)amino]ethylideneamino]hexanoic acid Formula: C14H21N3O2S MolecularWeight: 295.40044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(CCCCN)C(=O)O)NSC1=CC=CC=C1

Isomeric SMILES

CC(=N[C@@H](CCCCN)C(=O)O)NSC1=CC=CC=C1

InChI

InChI=1S/C14H21N3O2S/c1-11(17-20-12-7-3-2-4-8-12)16-13(14(18)19)9-5-6-10-15/h2-4,7-8,13H,5-6,9-10,15H2,1H3,(H,16,17)(H,18,19)/t13-/m0/s1