3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-4-fluoranyl-N-(3-methylphenyl)benzamide

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-4-fluoranyl-N-(3-methylphenyl)benzamide Openeye Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-4-fluoro-N-(m-tolyl)benzamide CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-4-fluoro-N-(3-methylphenyl)benzamide IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-4-fluoro-N-(3-methylphenyl)benzamide Traditional Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-4-fluoro-N-(m-tolyl)benzamide Formula: C20H25FN3O3S+ MolecularWeight: 406.494203

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C)F

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC(=C3)C)F

InChI

InChI=1S/C20H24FN3O3S/c1-3-23-9-11-24(12-10-23)28(26,27)19-14-16(7-8-18(19)21)20(25)22-17-6-4-5-15(2)13-17/h4-8,13-14H,3,9-12H2,1-2H3,(H,22,25)/p+1