dimethyl-[2-[[(2-nitrophenyl)carbamothioylamino]carbamothioylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[(2-nitrophenyl)carbamothioylamino]carbamothioylamino]ethyl]azanium Openeye Name: dimethyl-[2-[[(2-nitrophenyl)carbamothioylamino]carbamothioylamino]ethyl]ammonium CAS Name: dimethyl-[2-[[[[(2-nitroanilino)-sulfanylidenemethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(2-nitrophenyl)carbamothioylamino]carbamothioylamino]ethyl]azanium Traditional Name: dimethyl-[2-[[(2-nitrophenyl)thiocarbamoylamino]thiocarbamoylamino]ethyl]ammonium Formula: C12H19N6O2S2+ MolecularWeight: 343.44826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NNC(=S)NC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCNC(=S)NNC(=S)NC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C12H18N6O2S2/c1-17(2)8-7-13-11(21)15-16-12(22)14-9-5-3-4-6-10(9)18(19)20/h3-6H,7-8H2,1-2H3,(H2,13,15,21)(H2,14,16,22)/p+1