[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-[(1R)-1-methylolpropyl]ammonium Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]C(C)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CC[C@H](CO)[NH2+][C@H](C)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H18N2OS/c1-3-10(8-16)14-9(2)13-15-11-6-4-5-7-12(11)17-13/h4-7,9-10,14,16H,3,8H2,1-2H3/p+1/t9-,10-/m1/s1