(E)-N1-methyl-2-nitro-N1'-[1-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine

Systemtic Name: (E)-N1-methyl-2-nitro-N1'-[1-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine Openeye Name: (E)-N1-methyl-2-nitro-N1'-[1-(thiazol-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine CAS Name: (E)-N1-methyl-2-nitro-N1'-[1-(2-thiazolylmethylthio)ethyl]ethene-1,1-diamine IUPAC Name: (E)-1-N-methyl-2-nitro-1-N'-[1-(1,3-thiazol-2-ylmethylsulfanyl)ethyl]ethene-1,1-diamine Traditional Name: methyl-[(E)-2-nitro-1-[1-(thiazol-2-ylmethylthio)ethylamino]vinyl]amine Formula: C9H14N4O2S2 MolecularWeight: 274.36306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=C[N+](=O)[O-])NC)SCC1=NC=CS1

Isomeric SMILES

CC(N/C(=C/[N+](=O)[O-])/NC)SCC1=NC=CS1

InChI

InChI=1S/C9H14N4O2S2/c1-7(12-8(10-2)5-13(14)15)17-6-9-11-3-4-16-9/h3-5,7,10,12H,6H2,1-2H3/b8-5+