(Z)-N-(1,3-Benzodioxol-5-Ylmethyl)-N'-{2-[({5-[(Dimethylamino)Methyl]-2-Furyl}Methyl)Sulfanyl]Ethyl}-2-Nitro-1,1-Ethenediamine

Molecule SVG Image

Properties Simple | Detailed

Formula C20H26N4O5S
IUPAC Name (z)-n1'-(1,3-benzodioxol-5-ylmethyl)-n1-[2-[[5-[(dimethylamino)methyl]-2-furyl]methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine
Molecular Mass 434.509 g·mol−1
Heat of Formation -204.1 ± 16.7 kJ·mol−1
Dipole Moment 7.88 ± 1.08 D
Volume 513.42 Å 3
Surface Area 453.69 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy 2.43 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-n-(1,3-benzodioxol-5-ylmethyl)-n'-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine
  • (z)-n-(1,3-benzodioxol-5-ylmethyl)-n'-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethyl]-2-nitroethene-1,1-diamine
  • (z)-n-(1,3-benzodioxol-5-ylmethyl)-n'-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-nitro-ethene-1,1-diamine
  • (z)-n-(1,3-benzodioxol-5-ylmethyl)-n'-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethyl]-2-nitroethene-1,1-diamine
  • 1,1-ethenediamine, n-(1,3-benzodioxol-5-ylmethyl)-n'-(2-(((5-((dimethylamino)methyl)-2-furanyl)methyl)thio)ethyl)-2-nitro-
  • 1,3-benzodioxol-5-ylmethyl-[(z)-1-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethylamino]-2-nitro-vinyl]amine
  • n-(1,3-benzodioxol-5-ylmethyl)-n'-(2-((5-((dimethylamino)methyl)furfuryl)thio)ethyl)-2-nitrovinylidenediamine
  • n-(2-((5-((dimethylamino)methyl)furfuryl)thio)ethyl)-2-nitro-n'-piperonyl-1,1-ethenediamine
  • niperotidina [spanish]
  • niperotidine
  • niperotidinum [latin]
  • piperonyl-ranitidine
CAS Number(s)
  • 84845-75-0
InChIKey HXRSXEDVVARPHP-UDWIEESQSA-N
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