2-[[2-isocyanato-1-(isocyanatomethylsulfanyl)ethyl]sulfanylmethyl]-5-(isocyanatomethylsulfanylmethyl)-1,4-dithiane

Systemtic Name: 2-[[2-isocyanato-1-(isocyanatomethylsulfanyl)ethyl]sulfanylmethyl]-5-(isocyanatomethylsulfanylmethyl)-1,4-dithiane Openeye Name: 2-[[2-isocyanato-1-(isocyanatomethylsulfanyl)ethyl]sulfanylmethyl]-5-(isocyanatomethylsulfanylmethyl)-1,4-dithiane CAS Name: 2-[[[2-isocyanato-1-(isocyanatomethylthio)ethyl]thio]methyl]-5-[(isocyanatomethylthio)methyl]-1,4-dithiane IUPAC Name: 2-[[2-isocyanato-1-(isocyanatomethylsulfanyl)ethyl]sulfanylmethyl]-5-(isocyanatomethylsulfanylmethyl)-1,4-dithiane Traditional Name: 2-[[[2-isocyanato-1-(isocyanatomethylthio)ethyl]thio]methyl]-5-[(isocyanatomethylthio)methyl]-1,4-dithiane Formula: C13H17N3O3S5 MolecularWeight: 423.61738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SCC(S1)CSC(CN=C=O)SCN=C=O)CSCN=C=O

Isomeric SMILES

C1C(SCC(S1)CSC(CN=C=O)SCN=C=O)CSCN=C=O

InChI

InChI=1S/C13H17N3O3S5/c17-6-14-1-13(24-10-16-8-19)23-5-12-4-21-11(3-22-12)2-20-9-15-7-18/h11-13H,1-5,9-10H2