2-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-(1-naphthyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazine-1,4-diiumyl]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazine-1,4-diium-1-yl]-N-(1-naphthyl)acetamide Formula: C24H26N4OS+2 MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H24N4OS/c29-23(25-20-10-5-7-18-6-1-2-8-19(18)20)16-27-12-14-28(15-13-27)17-24-26-21-9-3-4-11-22(21)30-24/h1-11H,12-17H2,(H,25,29)/p+2