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

Systemtic Name: [2-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxidanylidene-ethoxy]-5-(1,3-benzothiazol-2-yl)phenyl]methyl-dimethyl-azanium Openeye Name: [2-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxo-ethoxy]-5-(1,3-benzothiazol-2-yl)phenyl]methyl-dimethyl-ammonium CAS Name: [2-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxoethoxy]-5-(1,3-benzothiazol-2-yl)phenyl]methyl-dimethylammonium IUPAC Name: [2-[2-(1H-benzimidazol-2-ylmethylamino)-2-oxoethoxy]-5-(1,3-benzothiazol-2-yl)phenyl]methyl-dimethylazanium Traditional Name: [2-[2-(1H-benzimidazol-2-ylmethylamino)-2-keto-ethoxy]-5-(1,3-benzothiazol-2-yl)benzyl]-dimethyl-ammonium Formula: C26H26N5O2S+ MolecularWeight: 472.58194

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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)NCC4=NC5=CC=CC=C5N4

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3S2)OCC(=O)NCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C26H25N5O2S/c1-31(2)15-18-13-17(26-30-21-9-5-6-10-23(21)34-26)11-12-22(18)33-16-25(32)27-14-24-28-19-7-3-4-8-20(19)29-24/h3-13H,14-16H2,1-2H3,(H,27,32)(H,28,29)/p+1