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

Systemtic Name: [2-(2,4-dimethylphenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(2,4-dimethylphenyl)-5-(5-methyl-2-furyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(2,4-dimethylphenyl)-5-(5-methyl-2-furanyl)-3-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(2,4-dimethylphenyl)-5-(5-methylfuran-2-yl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(2,4-dimethylphenyl)-5-(5-methyl-2-furyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2/c1-5-25-10-12-26(13-11-25)23(28)21-15-19(22-9-7-18(4)29-22)24-27(21)20-8-6-16(2)14-17(20)3/h6-9,14-15H,5,10-13H2,1-4H3/p+1