4-fluoranyl-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-3-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-3-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]benzothiophene-2-carboxamide Formula: C21H23FN3OS+ MolecularWeight: 384.490223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

InChI

InChI=1S/C21H22FN3OS/c1-14-19-15(22)6-5-9-18(19)27-20(14)21(26)23-16-7-3-4-8-17(16)25-12-10-24(2)11-13-25/h3-9H,10-13H2,1-2H3,(H,23,26)/p+1