[2,5-bis(oxidanylidene)pyrrolidin-1-yl] 6-[2-(2-acetamido-4-azanyl-3-oxidanylidene-butyl)sulfanylethanoylamino]hexanoate

Systemtic Name: [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 6-[2-(2-acetamido-4-azanyl-3-oxidanylidene-butyl)sulfanylethanoylamino]hexanoate Openeye Name: (2,5-dioxopyrrolidin-1-yl) 6-[[2-(2-acetamido-4-amino-3-oxo-butyl)sulfanylacetyl]amino]hexanoate CAS Name: 6-[[2-[(2-acetamido-4-amino-3-oxobutyl)thio]-1-oxoethyl]amino]hexanoic acid (2,5-dioxo-1-pyrrolidinyl) ester IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 6-[[2-(2-acetamido-4-amino-3-oxobutyl)sulfanylacetyl]amino]hexanoate Traditional Name: 6-[[2-[(2-acetamido-4-amino-3-keto-butyl)thio]acetyl]amino]hexanoic acid succinimido ester Formula: C18H28N4O7S MolecularWeight: 444.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSCC(=O)NCCCCCC(=O)ON1C(=O)CCC1=O)C(=O)CN

Isomeric SMILES

CC(=O)NC(CSCC(=O)NCCCCCC(=O)ON1C(=O)CCC1=O)C(=O)CN

InChI

InChI=1S/C18H28N4O7S/c1-12(23)21-13(14(24)9-19)10-30-11-15(25)20-8-4-2-3-5-18(28)29-22-16(26)6-7-17(22)27/h13H,2-11,19H2,1H3,(H,20,25)(H,21,23)