N1-methyl-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2,2-dinitro-ethene-1,1-diamine

Systemtic Name: N1-methyl-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2,2-dinitro-ethene-1,1-diamine Openeye Name: N1-methyl-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2,2-dinitro-ethene-1,1-diamine CAS Name: N1-methyl-N1'-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]-2,2-dinitroethene-1,1-diamine IUPAC Name: 1-N-methyl-1-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-2,2-dinitroethene-1,1-diamine Traditional Name: methyl-[1-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-2,2-dinitro-vinyl]amine Formula: C10H16N6O4S MolecularWeight: 316.33684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N6O4S/c1-7-8(14-6-13-7)5-21-4-3-12-9(11-2)10(15(17)18)16(19)20/h6,11-12H,3-5H2,1-2H3,(H,13,14)