(2S)-2-azanyl-5-[[(2S)-2-azanyl-2-nitroso-3-sulfanyl-propanoyl]-(2-ethoxy-2-oxidanylidene-ethyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[[(2S)-2-azanyl-2-nitroso-3-sulfanyl-propanoyl]-(2-ethoxy-2-oxidanylidene-ethyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[[(2S)-2-amino-2-nitroso-3-sulfanyl-propanoyl]-(2-ethoxy-2-oxo-ethyl)amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[[(2S)-2-amino-3-mercapto-2-nitroso-1-oxopropyl]-(2-ethoxy-2-oxoethyl)amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[[(2S)-2-amino-2-nitroso-3-sulfanylpropanoyl]-(2-ethoxy-2-oxoethyl)amino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[[(2S)-2-amino-3-mercapto-2-nitroso-propanoyl]-(2-ethoxy-2-keto-ethyl)amino]-5-keto-valeric acid Formula: C12H20N4O7S MolecularWeight: 364.3748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(=O)CCC(C(=O)O)N)C(=O)C(CS)(N)N=O

Isomeric SMILES

CCOC(=O)CN(C(=O)CC[C@@H](C(=O)O)N)C(=O)[C@](CS)(N)N=O

InChI

InChI=1S/C12H20N4O7S/c1-2-23-9(18)5-16(11(21)12(14,6-24)15-22)8(17)4-3-7(13)10(19)20/h7,24H,2-6,13-14H2,1H3,(H,19,20)/t7-,12+/m0/s1