[1-(4-fluorophenyl)-3-(3-methylphenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-(4-fluorophenyl)-3-(3-methylphenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(4-fluorophenyl)-3-(m-tolyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(4-fluorophenyl)-3-(3-methylphenyl)-4-pyrazolyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(4-fluorophenyl)-3-(3-methylphenyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(4-fluorophenyl)-3-(m-tolyl)pyrazol-4-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C24H28FN4O+ MolecularWeight: 407.503723

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)C)C4=CC=C(C=C4)F

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)C)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H27FN4O/c1-3-11-27-12-14-28(15-13-27)24(30)22-17-29(21-9-7-20(25)8-10-21)26-23(22)19-6-4-5-18(2)16-19/h4-10,16-17H,3,11-15H2,1-2H3/p+1