N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]benzamide CAS Name: N-[3-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-4,5-dimethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethylthiophen-2-yl]benzamide Traditional Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]benzamide Formula: C24H27FN3OS+ MolecularWeight: 424.554083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H26FN3OS/c1-17-18(2)30-24(26-23(29)19-8-4-3-5-9-19)20(17)16-27-12-14-28(15-13-27)22-11-7-6-10-21(22)25/h3-11H,12-16H2,1-2H3,(H,26,29)/p+1