(3-bromanyl-4,5-dimethoxy-phenyl)methylidene-(carbamothioylamino)azanium

Systemtic Name: (3-bromanyl-4,5-dimethoxy-phenyl)methylidene-(carbamothioylamino)azanium Openeye Name: (3-bromo-4,5-dimethoxy-phenyl)methylene-(carbamothioylamino)ammonium CAS Name: (3-bromo-4,5-dimethoxyphenyl)methylidene-(carbamothioylamino)ammonium IUPAC Name: (3-bromo-4,5-dimethoxyphenyl)methylidene-(carbamothioylamino)azanium Traditional Name: (3-bromo-4,5-dimethoxy-benzylidene)-thioureido-ammonium Formula: C10H13BrN3O2S+ MolecularWeight: 319.19812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=[NH+]NC(=S)N)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=[NH+]NC(=S)N)Br)OC

InChI

InChI=1S/C10H12BrN3O2S/c1-15-8-4-6(5-13-14-10(12)17)3-7(11)9(8)16-2/h3-5H,1-2H3,(H3,12,14,17)/p+1