2-nitro-N1,N1'-bis[2-(1,3-thiazol-2-ylmethylsulfinyl)ethyl]ethene-1,1-diamine

Systemtic Name: 2-nitro-N1,N1'-bis[2-(1,3-thiazol-2-ylmethylsulfinyl)ethyl]ethene-1,1-diamine Openeye Name: 2-nitro-N1,N1'-bis[2-(thiazol-2-ylmethylsulfinyl)ethyl]ethene-1,1-diamine CAS Name: 2-nitro-N1,N1'-bis[2-(2-thiazolylmethylsulfinyl)ethyl]ethene-1,1-diamine IUPAC Name: 2-nitro-1-N,1-N'-bis[2-(1,3-thiazol-2-ylmethylsulfinyl)ethyl]ethene-1,1-diamine Traditional Name: [2-nitro-1-[2-(thiazol-2-ylmethylsulfinyl)ethylamino]vinyl]-[2-(thiazol-2-ylmethylsulfinyl)ethyl]amine Formula: C14H19N5O4S4 MolecularWeight: 449.59176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=N1)CS(=O)CCNC(=C[N+](=O)[O-])NCCS(=O)CC2=NC=CS2

Isomeric SMILES

C1=CSC(=N1)CS(=O)CCNC(=C[N+](=O)[O-])NCCS(=O)CC2=NC=CS2

InChI

InChI=1S/C14H19N5O4S4/c20-19(21)9-12(15-3-7-26(22)10-13-17-1-5-24-13)16-4-8-27(23)11-14-18-2-6-25-14/h1-2,5-6,9,15-16H,3-4,7-8,10-11H2