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

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-6-phenyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-6-phenyl-2H-1,2,4-triazin-5-one CAS Name: 3-[(4-bromophenyl)methylthio]-6-phenyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-6-phenyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[(4-bromobenzyl)thio]-6-phenyl-2H-1,2,4-triazin-5-one Formula: C16H12BrN3OS MolecularWeight: 374.25498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=NC2=O)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H12BrN3OS/c17-13-8-6-11(7-9-13)10-22-16-18-15(21)14(19-20-16)12-4-2-1-3-5-12/h1-9H,10H2,(H,18,20,21)