(E)-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-nitro-N1-[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine

Systemtic Name: (E)-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-nitro-N1-[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine Openeye Name: (E)-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-nitro-N1-(3-oxazol-2-ylsulfanylpropyl)ethene-1,1-diamine CAS Name: (E)-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-2-nitro-N1-[3-(2-oxazolylthio)propyl]ethene-1,1-diamine IUPAC Name: (E)-1-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2-nitro-1-N-[3-(1,3-oxazol-2-ylsulfanyl)propyl]ethene-1,1-diamine Traditional Name: 2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl-[(E)-2-nitro-1-[3-(oxazol-2-ylthio)propylamino]vinyl]amine Formula: C15H22N6O3S2 MolecularWeight: 398.50358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC(=C[N+](=O)[O-])NCCCSC2=NC=CO2

Isomeric SMILES

CC1=C(N=CN1)CSCCN/C(=C/[N+](=O)[O-])/NCCCSC2=NC=CO2

InChI

InChI=1S/C15H22N6O3S2/c1-12-13(20-11-19-12)10-25-8-5-17-14(9-21(22)23)16-3-2-7-26-15-18-4-6-24-15/h4,6,9,11,16-17H,2-3,5,7-8,10H2,1H3,(H,19,20)/b14-9+