5-(8-azanyl-8-oxidanylidene-1-sulfanyl-octan-3-yl)sulfanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(8-azanyl-8-oxidanylidene-1-sulfanyl-octan-3-yl)sulfanyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-[6-amino-6-oxo-1-(2-sulfanylethyl)hexyl]sulfanyl-5-oxo-pentanoic acid CAS Name: 5-[(8-amino-1-mercapto-8-oxooctan-3-yl)thio]-5-oxopentanoic acid IUPAC Name: 5-(8-amino-8-oxo-1-sulfanyloctan-3-yl)sulfanyl-5-oxopentanoic acid Traditional Name: 5-[[6-amino-6-keto-1-(2-mercaptoethyl)hexyl]thio]-5-keto-valeric acid Formula: C13H23NO4S2 MolecularWeight: 321.45602

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)N)CC(CCS)SC(=O)CCCC(=O)O

Isomeric SMILES

C(CCC(=O)N)CC(CCS)SC(=O)CCCC(=O)O

InChI

InChI=1S/C13H23NO4S2/c14-11(15)5-2-1-4-10(8-9-19)20-13(18)7-3-6-12(16)17/h10,19H,1-9H2,(H2,14,15)(H,16,17)