(2S)-5-(aminomethyl)-2-azanyl-6-(ethanethioylamino)hexanoic acid

Systemtic Name: (2S)-5-(aminomethyl)-2-azanyl-6-(ethanethioylamino)hexanoic acid Openeye Name: (2S)-2-amino-5-(aminomethyl)-6-(ethanethioylamino)hexanoic acid CAS Name: (2S)-2-amino-5-(aminomethyl)-6-(1-sulfanylideneethylamino)hexanoic acid IUPAC Name: (2S)-2-amino-5-(aminomethyl)-6-(ethanethioylamino)hexanoic acid Traditional Name: (2S)-2-amino-5-(aminomethyl)-6-(thioacetylamino)hexanoic acid Formula: C9H19N3O2S MolecularWeight: 233.33106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NCC(CCC(C(=O)O)N)CN

Isomeric SMILES

CC(=S)NCC(CC[C@@H](C(=O)O)N)CN

InChI

InChI=1S/C9H19N3O2S/c1-6(15)12-5-7(4-10)2-3-8(11)9(13)14/h7-8H,2-5,10-11H2,1H3,(H,12,15)(H,13,14)/t7?,8-/m0/s1