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

Systemtic Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-propan-2-yl-azanium Openeye Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-isopropyl-ammonium CAS Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-propan-2-ylammonium IUPAC Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-propan-2-ylazanium Traditional Name: [(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-isopropyl-ammonium Formula: C12H17N2S+ MolecularWeight: 221.34178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2S/c1-8(2)13-9(3)12-14-10-6-4-5-7-11(10)15-12/h4-9,13H,1-3H3/p+1/t9-/m1/s1