[5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-dimethyl-azanium

Systemtic Name: [5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-oxidanylidene-ethoxy]phenyl]methyl-dimethyl-azanium Openeye Name: [5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-oxo-ethoxy]phenyl]methyl-dimethyl-ammonium CAS Name: [5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-oxoethoxy]phenyl]methyl-dimethylammonium IUPAC Name: [5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-oxoethoxy]phenyl]methyl-dimethylazanium Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-[2-(cyclopentylamino)-2-keto-ethoxy]benzyl]-dimethyl-ammonium Formula: C23H28N3O2S+ MolecularWeight: 410.55232

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NC4CCCC4

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NC4CCCC4

InChI

InChI=1S/C23H27N3O2S/c1-26(2)14-17-13-16(23-25-19-9-5-6-10-21(19)29-23)11-12-20(17)28-15-22(27)24-18-7-3-4-8-18/h5-6,9-13,18H,3-4,7-8,14-15H2,1-2H3,(H,24,27)/p+1