[(1S)-2-phenyl-1-(5-propan-2-ylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]azanium chloride

Systemtic Name: [(1S)-2-phenyl-1-(5-propan-2-ylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]azanium chloride Openeye Name: [(1S)-1-(5-isopropylsulfanyl-1,3,4-oxadiazol-2-yl)-2-phenyl-ethyl]ammonium chloride CAS Name: [(1S)-2-phenyl-1-[5-(propan-2-ylthio)-1,3,4-oxadiazol-2-yl]ethyl]ammonium chloride IUPAC Name: [(1S)-2-phenyl-1-(5-propan-2-ylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]azanium chloride Traditional Name: [(1S)-1-[5-(isopropylthio)-1,3,4-oxadiazol-2-yl]-2-phenyl-ethyl]ammonium chloride Formula: C13H18ClN3OS MolecularWeight: 299.81952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(O1)C(CC2=CC=CC=C2)[NH3+].[Cl-]

Isomeric SMILES

CC(C)SC1=NN=C(O1)[C@H](CC2=CC=CC=C2)[NH3+].[Cl-]

InChI

InChI=1S/C13H17N3OS.ClH/c1-9(2)18-13-16-15-12(17-13)11(14)8-10-6-4-3-5-7-10;/h3-7,9,11H,8,14H2,1-2H3;1H/t11-;/m0./s1