1-[2,2-bis[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]imidazole

Systemtic Name: 1-[2,2-bis[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]imidazole Openeye Name: 1-[2,2-bis[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]imidazole CAS Name: 1-[2,2-bis[[3-(trifluoromethyl)phenyl]methylthio]ethyl]imidazole IUPAC Name: 1-[2,2-bis[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]imidazole Traditional Name: 1-[2,2-bis[[3-(trifluoromethyl)benzyl]thio]ethyl]imidazole Formula: C21H18F6N2S2 MolecularWeight: 476.501439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CSC(CN2C=CN=C2)SCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CSC(CN2C=CN=C2)SCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H18F6N2S2/c22-20(23,24)17-5-1-3-15(9-17)12-30-19(11-29-8-7-28-14-29)31-13-16-4-2-6-18(10-16)21(25,26)27/h1-10,14,19H,11-13H2