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

Systemtic Name: 4-fluoranyl-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-N-methyl-benzothiophene-2-carboxamide Formula: C17H21FN3O2S+ MolecularWeight: 350.430943

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN(C)C(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C17H20FN3O2S/c1-19-6-8-21(9-7-19)16(22)11-20(2)17(23)15-10-12-13(18)4-3-5-14(12)24-15/h3-5,10H,6-9,11H2,1-2H3/p+1