2-acetamido-N'-[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]pentanediamide

Systemtic Name: 2-acetamido-N'-[1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-3-sulfanyl-propan-2-yl]pentanediamide Openeye Name: 2-acetamido-N'-[2-[(2-amino-2-oxo-ethyl)amino]-2-oxo-1-(sulfanylmethyl)ethyl]pentanediamide CAS Name: 2-acetamido-N'-[1-[(2-amino-2-oxoethyl)amino]-3-mercapto-1-oxopropan-2-yl]pentanediamide IUPAC Name: 2-acetamido-N'-[1-[(2-amino-2-oxoethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]pentanediamide Traditional Name: 2-acetamido-N'-[2-[(2-amino-2-keto-ethyl)amino]-2-keto-1-(mercaptomethyl)ethyl]glutaramide Formula: C12H21N5O5S MolecularWeight: 347.39064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)NC(CS)C(=O)NCC(=O)N)C(=O)N

Isomeric SMILES

CC(=O)NC(CCC(=O)NC(CS)C(=O)NCC(=O)N)C(=O)N

InChI

InChI=1S/C12H21N5O5S/c1-6(18)16-7(11(14)21)2-3-10(20)17-8(5-23)12(22)15-4-9(13)19/h7-8,23H,2-5H2,1H3,(H2,13,19)(H2,14,21)(H,15,22)(H,16,18)(H,17,20)