4-[(E)-(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(2-bromanyl-4,5-dimethoxy-phenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(2-bromo-4,5-dimethoxy-phenyl)methyleneamino]-3-methyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(2-bromo-4,5-dimethoxyphenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(2-bromo-4,5-dimethoxyphenyl)methylideneamino]-3-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(2-bromo-4,5-dimethoxy-benzylidene)amino]-3-methyl-1H-1,2,4-triazole-5-thione Formula: C12H13BrN4O2S MolecularWeight: 357.22622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CC1=NNC(=S)N1/N=C/C2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C12H13BrN4O2S/c1-7-15-16-12(20)17(7)14-6-8-4-10(18-2)11(19-3)5-9(8)13/h4-6H,1-3H3,(H,16,20)/b14-6+