2-(1H-indol-3-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(1H-indol-3-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(1H-indol-3-yl)-1-[4-(3-thienylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(1H-indol-3-yl)-1-[4-(3-thiophenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(1H-indol-3-yl)-1-[4-(thiophen-3-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(1H-indol-3-yl)-1-[4-(3-thenyl)piperazin-4-ium-1-yl]ethanone Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)CC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)C(=O)CC3=CNC4=CC=CC=C43

InChI

InChI=1S/C19H21N3OS/c23-19(11-16-12-20-18-4-2-1-3-17(16)18)22-8-6-21(7-9-22)13-15-5-10-24-14-15/h1-5,10,12,14,20H,6-9,11,13H2/p+1