2-nitro-N1,N1'-bis[2-[[5-[[2,2,2-tris(fluoranyl)ethylamino]methyl]furan-2-yl]methylsulfanyl]ethyl]ethene-1,1-diamine

Systemtic Name: 2-nitro-N1,N1'-bis[2-[[5-[[2,2,2-tris(fluoranyl)ethylamino]methyl]furan-2-yl]methylsulfanyl]ethyl]ethene-1,1-diamine Openeye Name: 2-nitro-N1,N1'-bis[2-[[5-[(2,2,2-trifluoroethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]ethene-1,1-diamine CAS Name: 2-nitro-N1,N1'-bis[2-[[5-[(2,2,2-trifluoroethylamino)methyl]-2-furanyl]methylthio]ethyl]ethene-1,1-diamine IUPAC Name: 2-nitro-1-N,1-N'-bis[2-[[5-[(2,2,2-trifluoroethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]ethene-1,1-diamine Traditional Name: [2-nitro-1-[2-[[5-[(2,2,2-trifluoroethylamino)methyl]-2-furyl]methylthio]ethylamino]vinyl]-[2-[[5-[(2,2,2-trifluoroethylamino)methyl]-2-furyl]methylthio]ethyl]amine Formula: C22H29F6N5O4S2 MolecularWeight: 605.617179

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)CSCCNC(=C[N+](=O)[O-])NCCSCC2=CC=C(O2)CNCC(F)(F)F)CNCC(F)(F)F

Isomeric SMILES

C1=C(OC(=C1)CSCCNC(=C[N+](=O)[O-])NCCSCC2=CC=C(O2)CNCC(F)(F)F)CNCC(F)(F)F

InChI

InChI=1S/C22H29F6N5O4S2/c23-21(24,25)14-29-9-16-1-3-18(36-16)12-38-7-5-31-20(11-33(34)35)32-6-8-39-13-19-4-2-17(37-19)10-30-15-22(26,27)28/h1-4,11,29-32H,5-10,12-15H2