2-(2-methylindol-1-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2-methylindol-1-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(2-methylindol-1-yl)-1-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(2-methyl-1-indolyl)-1-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2-methylindol-1-yl)-1-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(2-methylindol-1-yl)-1-[4-(2-thenyl)piperazin-4-ium-1-yl]ethanone Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC4=CC=CS4

InChI

InChI=1S/C20H23N3OS/c1-16-13-17-5-2-3-7-19(17)23(16)15-20(24)22-10-8-21(9-11-22)14-18-6-4-12-25-18/h2-7,12-13H,8-11,14-15H2,1H3/p+1