4-[bis(fluoranyl)methylsulfanyl]-N-(2-methylpentan-3-yl)aniline

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-(2-methylpentan-3-yl)aniline Openeye Name: 4-(difluoromethylsulfanyl)-N-(1-ethyl-2-methyl-propyl)aniline CAS Name: 4-(difluoromethylthio)-N-(2-methylpentan-3-yl)aniline IUPAC Name: 4-(difluoromethylsulfanyl)-N-(2-methylpentan-3-yl)aniline Traditional Name: [4-(difluoromethylthio)phenyl]-(1-ethyl-2-methyl-propyl)amine Formula: C13H19F2NS MolecularWeight: 259.358466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)NC1=CC=C(C=C1)SC(F)F

Isomeric SMILES

CCC(C(C)C)NC1=CC=C(C=C1)SC(F)F

InChI

InChI=1S/C13H19F2NS/c1-4-12(9(2)3)16-10-5-7-11(8-6-10)17-13(14)15/h5-9,12-13,16H,4H2,1-3H3