(Z)-N1-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethyl]-2-nitro-N1'-prop-2-ynyl-ethene-1,1-diamine

Systemtic Name: (Z)-N1-[2-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]ethyl]-2-nitro-N1'-prop-2-ynyl-ethene-1,1-diamine Openeye Name: (Z)-N1-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethyl]-2-nitro-N1'-prop-2-ynyl-ethene-1,1-diamine CAS Name: (Z)-N1-[2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethyl]-2-nitro-N1'-prop-2-ynylethene-1,1-diamine IUPAC Name: (Z)-1-N-[2-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]ethyl]-2-nitro-1-N'-prop-2-ynylethene-1,1-diamine Traditional Name: 2-[(4-bromo-1H-imidazol-5-yl)methylthio]ethyl-[(Z)-2-nitro-1-(propargylamino)vinyl]amine Formula: C11H14BrN5O2S MolecularWeight: 360.23016

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=C[N+](=O)[O-])NCCSCC1=C(N=CN1)Br

Isomeric SMILES

C#CCN/C(=C/[N+](=O)[O-])/NCCSCC1=C(N=CN1)Br

InChI

InChI=1S/C11H14BrN5O2S/c1-2-3-13-10(6-17(18)19)14-4-5-20-7-9-11(12)16-8-15-9/h1,6,8,13-14H,3-5,7H2,(H,15,16)/b10-6-