2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-4-methoxy-4-methyl-pentan-2-yl]azanium

Systemtic Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-4-methoxy-4-methyl-pentan-2-yl]azanium Openeye Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(1S)-3-methoxy-1,3-dimethyl-butyl]ammonium CAS Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-4-methoxy-4-methylpentan-2-yl]ammonium IUPAC Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(2S)-4-methoxy-4-methylpentan-2-yl]azanium Traditional Name: 2-(1,3-benzothiazol-2-yl)ethyl-[(1S)-3-methoxy-1,3-dimethyl-butyl]ammonium Formula: C16H25N2OS+ MolecularWeight: 293.4475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2OS/c1-12(11-16(2,3)19-4)17-10-9-15-18-13-7-5-6-8-14(13)20-15/h5-8,12,17H,9-11H2,1-4H3/p+1/t12-/m0/s1