2,4-bis(azanyl)-3-oxidanylidene-2-(sulfanylmethyl)heptanedioic acid

Systemtic Name: 2,4-bis(azanyl)-3-oxidanylidene-2-(sulfanylmethyl)heptanedioic acid Openeye Name: 2,4-diamino-3-oxo-2-(sulfanylmethyl)heptanedioic acid CAS Name: 2,4-diamino-2-(mercaptomethyl)-3-oxoheptanedioic acid IUPAC Name: 2,4-diamino-3-oxo-2-(sulfanylmethyl)heptanedioic acid Traditional Name: 2,4-diamino-3-keto-2-(mercaptomethyl)pimelic acid Formula: C8H14N2O5S MolecularWeight: 250.27216

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(=O)C(CS)(C(=O)O)N)N

Isomeric SMILES

C(CC(=O)O)C(C(=O)C(CS)(C(=O)O)N)N

InChI

InChI=1S/C8H14N2O5S/c9-4(1-2-5(11)12)6(13)8(10,3-16)7(14)15/h4,16H,1-3,9-10H2,(H,11,12)(H,14,15)