2-nitro-N1,N1'-bis[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine

Systemtic Name: 2-nitro-N1,N1'-bis[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine Openeye Name: 2-nitro-N1,N1'-bis(3-oxazol-2-ylsulfanylpropyl)ethene-1,1-diamine CAS Name: 2-nitro-N1,N1'-bis[3-(2-oxazolylthio)propyl]ethene-1,1-diamine IUPAC Name: 2-nitro-1-N,1-N'-bis[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine Traditional Name: [2-nitro-1-[3-(oxazol-2-ylthio)propylamino]vinyl]-[3-(oxazol-2-ylthio)propyl]amine Formula: C14H19N5O4S2 MolecularWeight: 385.46176

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=N1)SCCCNC(=C[N+](=O)[O-])NCCCSC2=NC=CO2

Isomeric SMILES

C1=COC(=N1)SCCCNC(=C[N+](=O)[O-])NCCCSC2=NC=CO2

InChI

InChI=1S/C14H19N5O4S2/c20-19(21)11-12(15-3-1-9-24-13-17-5-7-22-13)16-4-2-10-25-14-18-6-8-23-14/h5-8,11,15-16H,1-4,9-10H2