6-[(4-bromophenyl)methylsulfanyl]-5-oxidanylidene-2H-1,2,4-triazin-3-olate

Systemtic Name: 6-[(4-bromophenyl)methylsulfanyl]-5-oxidanylidene-2H-1,2,4-triazin-3-olate Openeye Name: 6-[(4-bromophenyl)methylsulfanyl]-5-oxo-2H-1,2,4-triazin-3-olate CAS Name: 6-[(4-bromophenyl)methylthio]-5-oxo-2H-1,2,4-triazin-3-olate IUPAC Name: 6-[(4-bromophenyl)methylsulfanyl]-5-oxo-2H-1,2,4-triazin-3-olate Traditional Name: 6-[(4-bromobenzyl)thio]-5-keto-2H-1,2,4-triazin-3-olate Formula: C10H7BrN3O2S- MolecularWeight: 313.15048

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NNC(=NC2=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1CSC2=NNC(=NC2=O)[O-])Br

InChI

InChI=1S/C10H8BrN3O2S/c11-7-3-1-6(2-4-7)5-17-9-8(15)12-10(16)14-13-9/h1-4H,5H2,(H2,12,14,15,16)/p-1