2,4-dimethyl-8-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-5,7-diaza-1-azoniabicyclo[4.3.0]nona-1,3,5,8-tetraene

Molecular Formula: C20H17F3N5S+


InChI: InChI=1/C20H16F3N5S/c1-12-8-13(2)28-10-15(25-18(28)24-12)11-29-19-26-16(14-6-4-3-5-7-14)9-17(27-19)20(21,22)23/h3-10H,11H2,1-2H3/p+1/fC20H17F3N5S/h25H/q+1

InChIKey: InChIKey=NWAVAKJRSREHKD-RWVJJUOBCZ
SMILES: CC1=CC(=[N+]2C=C(NC2=N1)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CC=C4)C

Names:
    2,4-dimethyl-8-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylmethyl]-5,7-diaza-1-azoniabicyclo[4.3.0]nona-1,3,5,8-tetraene

Registries:
    PubChem CID 4102485
    PubChem ID 6025301