N-[1-azanyl-3-[[3-azanyl-2-(octanoylamino)-3-oxidanylidene-propyl]disulfanyl]-1-oxidanylidene-propan-2-yl]octanamide

Systemtic Name: N-[1-azanyl-3-[[3-azanyl-2-(octanoylamino)-3-oxidanylidene-propyl]disulfanyl]-1-oxidanylidene-propan-2-yl]octanamide Openeye Name: N-[2-amino-1-[[[3-amino-2-(octanoylamino)-3-oxo-propyl]disulfanyl]methyl]-2-oxo-ethyl]octanamide CAS Name: N-[1-amino-3-[[3-amino-3-oxo-2-(1-oxooctylamino)propyl]disulfanyl]-1-oxopropan-2-yl]octanamide IUPAC Name: N-[1-amino-3-[[3-amino-2-(octanoylamino)-3-oxopropyl]disulfanyl]-1-oxopropan-2-yl]octanamide Traditional Name: N-[2-amino-1-[[[3-amino-2-(caprylylamino)-3-keto-propyl]disulfanyl]methyl]-2-keto-ethyl]caprylamide Formula: C22H42N4O4S2 MolecularWeight: 490.72328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(CSSCC(C(=O)N)NC(=O)CCCCCCC)C(=O)N

Isomeric SMILES

CCCCCCCC(=O)NC(CSSCC(C(=O)N)NC(=O)CCCCCCC)C(=O)N

InChI

InChI=1S/C22H42N4O4S2/c1-3-5-7-9-11-13-19(27)25-17(21(23)29)15-31-32-16-18(22(24)30)26-20(28)14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3,(H2,23,29)(H2,24,30)(H,25,27)(H,26,28)