2-azanyl-5-[[5-azanyl-1-[carboxy(methyl)amino]-1-oxidanylidene-2-sulfanyl-pentan-2-yl]-sulfanyl-amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-azanyl-5-[[5-azanyl-1-[carboxy(methyl)amino]-1-oxidanylidene-2-sulfanyl-pentan-2-yl]-sulfanyl-amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-amino-5-[[4-amino-1-[carboxy(methyl)carbamoyl]-1-sulfanyl-butyl]-sulfanyl-amino]-5-oxo-pentanoic acid CAS Name: 2-amino-5-[[5-amino-1-[carboxy(methyl)amino]-2-mercapto-1-oxopentan-2-yl]-mercaptoamino]-5-oxopentanoic acid IUPAC Name: 2-amino-5-[[5-amino-1-[carboxy(methyl)amino]-1-oxo-2-sulfanylpentan-2-yl]-sulfanylamino]-5-oxopentanoic acid Traditional Name: 2-amino-5-[[4-amino-1-[carboxy(methyl)carbamoyl]-1-mercapto-butyl]-mercapto-amino]-5-keto-valeric acid Formula: C12H22N4O6S2 MolecularWeight: 382.45628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C(CCCN)(N(C(=O)CCC(C(=O)O)N)S)S)C(=O)O

Isomeric SMILES

CN(C(=O)C(CCCN)(N(C(=O)CCC(C(=O)O)N)S)S)C(=O)O

InChI

InChI=1S/C12H22N4O6S2/c1-15(11(21)22)10(20)12(23,5-2-6-13)16(24)8(17)4-3-7(14)9(18)19/h7,23-24H,2-6,13-14H2,1H3,(H,18,19)(H,21,22)