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

Systemtic Name: 4-[(E)-(2-bromanyl-5-oxidanyl-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(2-bromo-5-hydroxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(2-bromo-5-hydroxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(2-bromo-5-hydroxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(2-bromo-5-hydroxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C9H7BrN4OS MolecularWeight: 299.14708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C=NN2C=NNC2=S)Br

Isomeric SMILES

C1=CC(=C(C=C1O)/C=N/N2C=NNC2=S)Br

InChI

InChI=1S/C9H7BrN4OS/c10-8-2-1-7(15)3-6(8)4-12-14-5-11-13-9(14)16/h1-5,15H,(H,13,16)/b12-4+