2-[[8-tert-butyl-4-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-2-yl]sulfanyl]ethyl benzoate

Molecular Formula: C20H20F3N3O2S


InChI: InChI=1/C20H20F3N3O2S/c1-19(2,3)14-11-16-24-15(20(21,22)23)12-17(26(16)25-14)29-10-9-28-18(27)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3

InChIKey: InChIKey=BCRSBUJVCZJGKL-UHFFFAOYAT
SMILES: CC(C)(C)C1=NN2C(=C1)N=C(C=C2SCCOC(=O)C3=CC=CC=C3)C(F)(F)F

Names:
    2-[[8-tert-butyl-4-(trifluoromethyl)-1,5,9-triazabicyclo[4.3.0]nona-2,4,6,8-tetraen-2-yl]sulfanyl]ethyl benzoate

Registries:
    PubChem CID 2822198
    PubChem ID 3282447