1,1-bis(fluoranyl)-4-(phenylmethylsulfanyl)butan-2-amine hydrochloride

Systemtic Name: 1,1-bis(fluoranyl)-4-(phenylmethylsulfanyl)butan-2-amine hydrochloride Openeye Name: 4-benzylsulfanyl-1,1-difluoro-butan-2-amine hydrochloride CAS Name: 1,1-difluoro-4-(phenylmethylthio)-2-butanamine hydrochloride IUPAC Name: 4-benzylsulfanyl-1,1-difluorobutan-2-amine hydrochloride Traditional Name: [3-(benzylthio)-1-(difluoromethyl)propyl]amine hydrochloride Formula: C11H16ClF2NS MolecularWeight: 267.766246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCC(C(F)F)N.Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCCC(C(F)F)N.Cl

InChI

InChI=1S/C11H15F2NS.ClH/c12-11(13)10(14)6-7-15-8-9-4-2-1-3-5-9;/h1-5,10-11H,6-8,14H2;1H