[(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propyl]azanium

Systemtic Name: [(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propyl]azanium Openeye Name: [(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonyl-propyl]ammonium CAS Name: [(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonylpropyl]ammonium IUPAC Name: [(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-methylsulfonylpropyl]azanium Traditional Name: [(1S)-1-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-3-mesyl-propyl]ammonium Formula: C12H15BrN3O3S+ MolecularWeight: 361.2348

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C1=NC(=NO1)C2=CC(=CC=C2)Br)[NH3+]

Isomeric SMILES

CS(=O)(=O)CC[C@@H](C1=NC(=NO1)C2=CC(=CC=C2)Br)[NH3+]

InChI

InChI=1S/C12H14BrN3O3S/c1-20(17,18)6-5-10(14)12-15-11(16-19-12)8-3-2-4-9(13)7-8/h2-4,7,10H,5-6,14H2,1H3/p+1/t10-/m0/s1