3-[[(E)-1-(methylamino)-2-nitro-ethenyl]amino]propyl-(5-methylfuran-2-yl)-sulfanylidene-azanium iodide

Systemtic Name: 3-[[(E)-1-(methylamino)-2-nitro-ethenyl]amino]propyl-(5-methylfuran-2-yl)-sulfanylidene-azanium iodide Openeye Name: 3-[[(E)-1-(methylamino)-2-nitro-vinyl]amino]propyl-(5-methyl-2-furyl)-thioxo-ammonium iodide CAS Name: 3-[[(E)-1-(methylamino)-2-nitroethenyl]amino]propyl-(5-methyl-2-furanyl)-sulfanylideneammonium iodide IUPAC Name: 3-[[(E)-1-(methylamino)-2-nitroethenyl]amino]propyl-(5-methylfuran-2-yl)-sulfanylideneazanium iodide Traditional Name: 3-[[(E)-1-(methylamino)-2-nitro-vinyl]amino]propyl-(5-methyl-2-furyl)-thioxo-ammonium iodide Formula: C11H17IN4O3S MolecularWeight: 412.24715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)[N+](=S)CCCNC(=C[N+](=O)[O-])NC.[I-]

Isomeric SMILES

CC1=CC=C(O1)[N+](=S)CCCN/C(=C/[N+](=O)[O-])/NC.[I-]

InChI

InChI=1S/C11H17N4O3S.HI/c1-9-4-5-11(18-9)14(19)7-3-6-13-10(12-2)8-15(16)17;/h4-5,8,12-13H,3,6-7H2,1-2H3;1H/q+1;/p-1/b10-8+;