4-cyano-N-decyl-4-[[2-isocyano-5-oxidanylidene-5-[2-(trioxidanylsulfanyl)ethylamino]pentan-2-yl]diazenyl]pentanamide

Systemtic Name: 4-cyano-N-decyl-4-[[2-isocyano-5-oxidanylidene-5-[2-(trioxidanylsulfanyl)ethylamino]pentan-2-yl]diazenyl]pentanamide Openeye Name: 4-cyano-N-decyl-4-[1-isocyano-1-methyl-4-oxo-4-[2-(trioxidanylsulfanyl)ethylamino]butyl]azo-pentanamide CAS Name: 2-[[4-[2-cyano-5-(decylamino)-5-oxopentan-2-yl]azo-4-isocyano-1-oxopentyl]amino]ethanesulfenic acid hydroperoxy ester IUPAC Name: 4-cyano-N-decyl-4-[[2-isocyano-5-oxo-5-[2-(trioxidanylsulfanyl)ethylamino]pentan-2-yl]diazenyl]pentanamide Traditional Name: 4-cyano-N-decyl-4-[1-isocyano-4-keto-1-methyl-4-[2-(trioxidanylthio)ethylamino]butyl]azo-valeramide Formula: C24H42N6O5S MolecularWeight: 526.69248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC(=O)CCC(C)(C#N)N=NC(C)(CCC(=O)NCCSOOO)[N+]#[C-]

Isomeric SMILES

CCCCCCCCCCNC(=O)CCC(C)(C#N)N=NC(C)(CCC(=O)NCCSOOO)[N+]#[C-]

InChI

InChI=1S/C24H42N6O5S/c1-5-6-7-8-9-10-11-12-17-27-21(31)13-15-23(2,20-25)29-30-24(3,26-4)16-14-22(32)28-18-19-36-35-34-33/h33H,5-19H2,1-3H3,(H,27,31)(H,28,32)