3-azanyl-2-[(1-azanyl-2-fluoranyl-ethylidene)amino]-2-(2-sulfanylethyl)butanoic acid dihydrochloride

Systemtic Name: 3-azanyl-2-[(1-azanyl-2-fluoranyl-ethylidene)amino]-2-(2-sulfanylethyl)butanoic acid dihydrochloride Openeye Name: 3-amino-2-[(1-amino-2-fluoro-ethylidene)amino]-2-(2-sulfanylethyl)butanoic acid dihydrochloride CAS Name: 3-amino-2-[(1-amino-2-fluoroethylidene)amino]-2-(2-mercaptoethyl)butanoic acid dihydrochloride IUPAC Name: 3-amino-2-[(1-amino-2-fluoroethylidene)amino]-2-(2-sulfanylethyl)butanoic acid dihydrochloride Traditional Name: 3-amino-2-[(1-amino-2-fluoro-ethylidene)amino]-2-(2-mercaptoethyl)butyric acid dihydrochloride Formula: C8H18Cl2FN3O2S MolecularWeight: 310.216823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCS)(C(=O)O)N=C(CF)N)N.Cl.Cl

Isomeric SMILES

CC(C(CCS)(C(=O)O)N=C(CF)N)N.Cl.Cl

InChI

InChI=1S/C8H16FN3O2S.2ClH/c1-5(10)8(2-3-15,7(13)14)12-6(11)4-9;;/h5,15H,2-4,10H2,1H3,(H2,11,12)(H,13,14);2*1H