2-[1-[4-(4,5-diphenyl-1,3-thiazol-2-yl)butyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-[4-(4,5-diphenyl-1,3-thiazol-2-yl)butyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-[4-(4,5-diphenylthiazol-2-yl)butyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[1-[4-(4,5-diphenyl-2-thiazolyl)butyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-[4-(4,5-diphenyl-1,3-thiazol-2-yl)butyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[1-[4-(4,5-diphenylthiazol-2-yl)butyl]piperazin-1-ium-1-yl]acetamide Formula: C25H31N4OS+ MolecularWeight: 435.60484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CCCCC2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1C[N+](CCN1)(CCCCC2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C25H30N4OS/c26-22(30)19-29(17-14-27-15-18-29)16-8-7-13-23-28-24(20-9-3-1-4-10-20)25(31-23)21-11-5-2-6-12-21/h1-6,9-12,27H,7-8,13-19H2,(H-,26,30)/p+1