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

Systemtic Name: 3-[[3,5-bis(bromanyl)phenyl]methylsulfanyl]-6-methyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[(3,5-dibromophenyl)methylsulfanyl]-6-methyl-2H-1,2,4-triazin-5-one CAS Name: 3-[(3,5-dibromophenyl)methylthio]-6-methyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(3,5-dibromophenyl)methylsulfanyl]-6-methyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[(3,5-dibromobenzyl)thio]-6-methyl-2H-1,2,4-triazin-5-one Formula: C11H9Br2N3OS MolecularWeight: 391.08166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=NC1=O)SCC2=CC(=CC(=C2)Br)Br

Isomeric SMILES

CC1=NNC(=NC1=O)SCC2=CC(=CC(=C2)Br)Br

InChI

InChI=1S/C11H9Br2N3OS/c1-6-10(17)14-11(16-15-6)18-5-7-2-8(12)4-9(13)3-7/h2-4H,5H2,1H3,(H,14,16,17)