2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-pentan-2-yl]azanium Openeye Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(1S)-1-methylbutyl]ammonium CAS Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-pentan-2-yl]azanium Traditional Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(1S)-1-methylbutyl]ammonium Formula: C14H21N2S+ MolecularWeight: 249.39494

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCC[C@H](C)[NH2+]CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H20N2S/c1-3-6-11(2)15-10-9-14-16-12-7-4-5-8-13(12)17-14/h4-5,7-8,11,15H,3,6,9-10H2,1-2H3/p+1/t11-/m0/s1