2-(1,2-diisocyanatoethylsulfanylmethyl)-5-(isocyanatomethylsulfanylmethylsulfanylmethyl)-1,4-dithiane

Systemtic Name: 2-(1,2-diisocyanatoethylsulfanylmethyl)-5-(isocyanatomethylsulfanylmethylsulfanylmethyl)-1,4-dithiane Openeye Name: 2-(1,2-diisocyanatoethylsulfanylmethyl)-5-(isocyanatomethylsulfanylmethylsulfanylmethyl)-1,4-dithiane CAS Name: 2-[(1,2-diisocyanatoethylthio)methyl]-5-[[(isocyanatomethylthio)methylthio]methyl]-1,4-dithiane IUPAC Name: 2-(1,2-diisocyanatoethylsulfanylmethyl)-5-(isocyanatomethylsulfanylmethylsulfanylmethyl)-1,4-dithiane Traditional Name: 2-[(1,2-diisocyanatoethylthio)methyl]-5-[[(isocyanatomethylthio)methylthio]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)N=C=O)CSCSCN=C=O

Isomeric SMILES

C1C(SCC(S1)CSC(CN=C=O)N=C=O)CSCSCN=C=O

InChI

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