1-(4-phenethylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethanone

Systemtic Name: 1-(4-phenethylpiperazin-4-ium-1-yl)-2-thiophen-2-yl-ethanone Openeye Name: 1-(4-phenethylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethanone CAS Name: 1-(4-phenethyl-1-piperazin-4-iumyl)-2-thiophen-2-ylethanone IUPAC Name: 1-(4-phenethylpiperazin-4-ium-1-yl)-2-thiophen-2-ylethanone Traditional Name: 1-(4-phenethylpiperazin-4-ium-1-yl)-2-(2-thienyl)ethanone Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)CC3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C18H22N2OS/c21-18(15-17-7-4-14-22-17)20-12-10-19(11-13-20)9-8-16-5-2-1-3-6-16/h1-7,14H,8-13,15H2/p+1