(5-ethylthiophen-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-ethylthiophen-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-ethyl-3-thienyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-ethyl-3-thiophenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-ethylthiophen-3-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-ethyl-3-thienyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CS1)C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C19H24N2OS/c1-2-18-14-17(15-23-18)19(22)21-12-10-20(11-13-21)9-8-16-6-4-3-5-7-16/h3-7,14-15H,2,8-13H2,1H3/p+1