2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]azanium

Systemtic Name: 2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]azanium Openeye Name: 2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]ammonium CAS Name: 2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-1-cyclohex-3-enyl]methyl]ammonium IUPAC Name: 2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]azanium Traditional Name: 2-(1,3-benzothiazol-2-yl)ethyl-[[(1S)-cyclohex-3-en-1-yl]methyl]ammonium Formula: C16H21N2S+ MolecularWeight: 273.41634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C[NH2+]CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1C[C@@H](CC=C1)C[NH2+]CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H20N2S/c1-2-6-13(7-3-1)12-17-11-10-16-18-14-8-4-5-9-15(14)19-16/h1-2,4-5,8-9,13,17H,3,6-7,10-12H2/p+1/t13-/m1/s1