(E)-N1'-[2-[(3-ethoxypyridin-2-yl)methylsulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1'-[2-[(3-ethoxypyridin-2-yl)methylsulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1'-[2-[(3-ethoxy-2-pyridyl)methylsulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1'-[2-[(3-ethoxy-2-pyridinyl)methylthio]ethyl]-N1-methyl-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N'-[2-[(3-ethoxypyridin-2-yl)methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine Traditional Name: 2-[(3-ethoxy-2-pyridyl)methylthio]ethyl-[(E)-1-(methylamino)-2-nitro-vinyl]amine Formula: C13H20N4O3S MolecularWeight: 312.3879

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=CC=C1)CSCCNC(=C[N+](=O)[O-])NC

Isomeric SMILES

CCOC1=C(N=CC=C1)CSCCN/C(=C/[N+](=O)[O-])/NC

InChI

InChI=1S/C13H20N4O3S/c1-3-20-12-5-4-6-15-11(12)10-21-8-7-16-13(14-2)9-17(18)19/h4-6,9,14,16H,3,7-8,10H2,1-2H3/b13-9+