1-(isothiocyanatomethyl)-4-(trifluoromethylsulfanyl)benzene

Systemtic Name: 1-(isothiocyanatomethyl)-4-(trifluoromethylsulfanyl)benzene Openeye Name: 1-(isothiocyanatomethyl)-4-(trifluoromethylsulfanyl)benzene CAS Name: 1-(isothiocyanatomethyl)-4-(trifluoromethylthio)benzene IUPAC Name: 1-(isothiocyanatomethyl)-4-(trifluoromethylsulfanyl)benzene Traditional Name: 1-(isothiocyanatomethyl)-4-(trifluoromethylthio)benzene Formula: C9H6F3NS2 MolecularWeight: 249.27585

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN=C=S)SC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1CN=C=S)SC(F)(F)F

InChI

InChI=1S/C9H6F3NS2/c10-9(11,12)15-8-3-1-7(2-4-8)5-13-6-14/h1-4H,5H2