prop-2-enyl 9-[3-(trifluoromethyloxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioate

Systemtic Name: prop-2-enyl 9-[3-(trifluoromethyloxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioate Openeye Name: allyl 9-[3-(trifluoromethoxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioate CAS Name: 9-[3-(trifluoromethoxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 9-[3-(trifluoromethoxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioate Traditional Name: 9-[3-(trifluoromethoxy)phenyl]imino-10-thia-8-azaspiro[5.5]undecane-8-carbodithioic acid allyl ester Formula: C20H23F3N2OS3 MolecularWeight: 460.59963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC(=S)N1CC2(CCCCC2)CSC1=NC3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

C=CCSC(=S)N1CC2(CCCCC2)CSC1=NC3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C20H23F3N2OS3/c1-2-11-28-18(27)25-13-19(9-4-3-5-10-19)14-29-17(25)24-15-7-6-8-16(12-15)26-20(21,22)23/h2,6-8,12H,1,3-5,9-11,13-14H2