(4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(5-methyl-2-furyl)pyrazol-3-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[2-(4-fluorophenyl)-5-(5-methyl-2-furanyl)-3-pyrazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(5-methyl-2-furyl)pyrazol-3-yl]methanone Formula: C21H24FN4O2+ MolecularWeight: 383.439263

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=C(O4)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=C(O4)C

InChI

InChI=1S/C21H23FN4O2/c1-3-24-10-12-25(13-11-24)21(27)19-14-18(20-9-4-15(2)28-20)23-26(19)17-7-5-16(22)6-8-17/h4-9,14H,3,10-13H2,1-2H3/p+1