2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)sulfanyl]-1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(4,5-diphenyl-1H-imidazol-2-yl)thio]-1-(4-pyridin-1-ium-2-ylpiperazino)ethanone Formula: C26H26N5OS+ MolecularWeight: 456.58254

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CSC3=NC(=C(N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)CSC3=NC(=C(N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5OS/c32-23(31-17-15-30(16-18-31)22-13-7-8-14-27-22)19-33-26-28-24(20-9-3-1-4-10-20)25(29-26)21-11-5-2-6-12-21/h1-14H,15-19H2,(H,28,29)/p+1