[(2S)-1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(3-chloro-4-fluoro-phenyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(3-chloro-4-fluoroanilino)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(3-chloro-4-fluoroanilino)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(3-chloro-4-fluoro-phenyl)carbamoyl]-3-(methylthio)propyl]ammonium Formula: C11H15ClFN2OS+ MolecularWeight: 277.766003

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC(=C(C=C1)F)Cl)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC(=C(C=C1)F)Cl)[NH3+]

InChI

InChI=1S/C11H14ClFN2OS/c1-17-5-4-10(14)11(16)15-7-2-3-9(13)8(12)6-7/h2-3,6,10H,4-5,14H2,1H3,(H,15,16)/p+1/t10-/m0/s1