2-[4-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]piperazin-1-ium-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-[4-(1,3-benzothiazol-2-yl)-2-quinolyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[4-(1,3-benzothiazol-2-yl)-2-quinolinyl]-1-piperazin-1-iumyl]-N,N-dimethylacetamide IUPAC Name: 2-[4-[4-(1,3-benzothiazol-2-yl)quinolin-2-yl]piperazin-1-ium-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-[4-(1,3-benzothiazol-2-yl)-2-quinolyl]piperazin-1-ium-1-yl]-N,N-dimethyl-acetamide Formula: C24H26N5OS+ MolecularWeight: 432.56114

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C2=NC3=CC=CC=C3C(=C2)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H25N5OS/c1-27(2)23(30)16-28-11-13-29(14-12-28)22-15-18(17-7-3-4-8-19(17)25-22)24-26-20-9-5-6-10-21(20)31-24/h3-10,15H,11-14,16H2,1-2H3/p+1