[(2S)-3-(1,3-benzothiazol-2-ylsulfanyl)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(1,3-benzothiazol-2-ylsulfanyl)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(1,3-benzothiazol-2-ylsulfanyl)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(1,3-benzothiazol-2-ylthio)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(1,3-benzothiazol-2-ylsulfanyl)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(1,3-benzothiazol-2-ylthio)-2-hydroxy-propyl]-methyl-ammonium Formula: C11H15N2OS2+ MolecularWeight: 255.3796

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]CC(CSC1=NC2=CC=CC=C2S1)O

Isomeric SMILES

C[NH2+]C[C@@H](CSC1=NC2=CC=CC=C2S1)O

InChI

InChI=1S/C11H14N2OS2/c1-12-6-8(14)7-15-11-13-9-4-2-3-5-10(9)16-11/h2-5,8,12,14H,6-7H2,1H3/p+1/t8-/m0/s1