3-azanyl-4-sulfanyl-pentane-1-sulfonic acid

Systemtic Name: 3-azanyl-4-sulfanyl-pentane-1-sulfonic acid Openeye Name: 3-amino-4-sulfanyl-pentane-1-sulfonic acid CAS Name: 3-amino-4-mercapto-1-pentanesulfonic acid IUPAC Name: 3-amino-4-sulfanylpentane-1-sulfonic acid Traditional Name: 3-amino-4-mercapto-pentane-1-sulfonic acid Formula: C5H13NO3S2 MolecularWeight: 199.29162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCS(=O)(=O)O)N)S

Isomeric SMILES

CC(C(CCS(=O)(=O)O)N)S

InChI

InChI=1S/C5H13NO3S2/c1-4(10)5(6)2-3-11(7,8)9/h4-5,10H,2-3,6H2,1H3,(H,7,8,9)