6-[(3-bromophenyl)methylsulfanyl]-3-methyl-2,4-dihydro-1H-1,3,5-triazin-5-ium

Systemtic Name: 6-[(3-bromophenyl)methylsulfanyl]-3-methyl-2,4-dihydro-1H-1,3,5-triazin-5-ium Openeye Name: 6-[(3-bromophenyl)methylsulfanyl]-3-methyl-2,4-dihydro-1H-1,3,5-triazin-5-ium CAS Name: 6-[(3-bromophenyl)methylthio]-3-methyl-2,4-dihydro-1H-1,3,5-triazin-5-ium IUPAC Name: 6-[(3-bromophenyl)methylsulfanyl]-3-methyl-2,4-dihydro-1H-1,3,5-triazin-5-ium Traditional Name: 6-[(3-bromobenzyl)thio]-3-methyl-2,4-dihydro-1H-s-triazin-5-ium Formula: C11H15BrN3S+ MolecularWeight: 301.2259

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Descriptors Computed from Structure

Canonical SMILES:

CN1CNC(=[NH+]C1)SCC2=CC(=CC=C2)Br

Isomeric SMILES

CN1CNC(=[NH+]C1)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C11H14BrN3S/c1-15-7-13-11(14-8-15)16-6-9-3-2-4-10(12)5-9/h2-5H,6-8H2,1H3,(H,13,14)/p+1