7-(iodomethyl)-2-(4-methylphenyl)-6-thia-3,4-diaza-1-azoniabicyclo[3.3.0]octa-2,4-diene

Molecular Formula: C12H13IN3S+


InChI: InChI=1/C12H12IN3S/c1-8-2-4-9(5-3-8)11-14-15-12-16(11)7-10(6-13)17-12/h2-5,10H,6-7H2,1H3/p+1/fC12H13IN3S/h16H/q+1

InChIKey: InChIKey=RJXJTWDAUHWNOC-LSGHBYNYCP
SMILES: CC1=CC=C(C=C1)C2=NN=C3[NH+]2CC(S3)CI

Names:
    7-(iodomethyl)-2-(4-methylphenyl)-6-thia-3,4-diaza-1-azoniabicyclo[3.3.0]octa-2,4-diene

Registries:
    PubChem CID 3574573
    PubChem ID 4844721