1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-oxoethyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-oxoethyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[2-(cyclohexylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H24N3OS+ MolecularWeight: 318.45696

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3CCCCC3

Isomeric SMILES

C[NH+](CC1=NC2=CC=CC=C2S1)CC(=O)NC3CCCCC3

InChI

InChI=1S/C17H23N3OS/c1-20(11-16(21)18-13-7-3-2-4-8-13)12-17-19-14-9-5-6-10-15(14)22-17/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3,(H,18,21)/p+1