N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-2-(3-fluorophenyl)ethanamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonyl-phenyl]-2-(3-fluorophenyl)ethanamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-(1-piperidylsulfonyl)phenyl]-2-(3-fluorophenyl)acetamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)-5-(1-piperidinylsulfonyl)phenyl]-2-(3-fluorophenyl)acetamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylphenyl]-2-(3-fluorophenyl)acetamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)-5-piperidinosulfonyl-phenyl]-2-(3-fluorophenyl)acetamide Formula: C25H34FN4O3S+ MolecularWeight: 489.625863

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CC4=CC(=CC=C4)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)NC(=O)CC4=CC(=CC=C4)F

InChI

InChI=1S/C25H33FN4O3S/c1-2-28-13-15-29(16-14-28)24-10-9-22(34(32,33)30-11-4-3-5-12-30)19-23(24)27-25(31)18-20-7-6-8-21(26)17-20/h6-10,17,19H,2-5,11-16,18H2,1H3,(H,27,31)/p+1