1,3-benzothiazol-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1,4-dimethylpentyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(2S)-5-methylhexan-2-yl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(2S)-5-methylhexan-2-yl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(1S)-1,4-dimethylpentyl]ammonium Formula: C15H23N2S+ MolecularWeight: 263.42152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H22N2S/c1-11(2)8-9-12(3)16-10-15-17-13-6-4-5-7-14(13)18-15/h4-7,11-12,16H,8-10H2,1-3H3/p+1/t12-/m0/s1