N-[2-(1H-indol-3-yl)ethyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-(4-thiophen-2-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-2-[4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide Formula: C21H25N4O2S+ MolecularWeight: 397.5138

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CNC3=CC=CC=C32)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CNC3=CC=CC=C32)C(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O2S/c26-20(22-8-7-16-14-23-18-5-2-1-4-17(16)18)15-24-9-11-25(12-10-24)21(27)19-6-3-13-28-19/h1-6,13-14,23H,7-12,15H2,(H,22,26)/p+1