[(2R)-2-[(3-fluorophenyl)methyl-methyl-amino]-2-(4-methylsulfanylphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[(3-fluorophenyl)methyl-methyl-amino]-2-(4-methylsulfanylphenyl)ethyl]azanium Openeye Name: [(2R)-2-[(3-fluorophenyl)methyl-methyl-amino]-2-(4-methylsulfanylphenyl)ethyl]ammonium CAS Name: [(2R)-2-[(3-fluorophenyl)methyl-methylamino]-2-[4-(methylthio)phenyl]ethyl]ammonium IUPAC Name: [(2R)-2-[(3-fluorophenyl)methyl-methylamino]-2-(4-methylsulfanylphenyl)ethyl]azanium Traditional Name: [(2R)-2-[(3-fluorobenzyl)-methyl-amino]-2-[4-(methylthio)phenyl]ethyl]ammonium Formula: C17H22FN2S+ MolecularWeight: 305.433383

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)C(C[NH3+])C2=CC=C(C=C2)SC

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)[C@@H](C[NH3+])C2=CC=C(C=C2)SC

InChI

InChI=1S/C17H21FN2S/c1-20(12-13-4-3-5-15(18)10-13)17(11-19)14-6-8-16(21-2)9-7-14/h3-10,17H,11-12,19H2,1-2H3/p+1/t17-/m0/s1