1-[4-[1-(3-chlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-(3-chlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazol-4-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-(3-chlorophenyl)-5-ethyl-3-isobutyl-pyrazole-4-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[1-(3-chlorophenyl)-5-ethyl-3-(2-methylpropyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[1-(3-chlorophenyl)-5-ethyl-3-(2-methylpropyl)pyrazole-4-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[1-(3-chlorophenyl)-5-ethyl-3-isobutyl-pyrazole-4-carbonyl]piperazino]ethanone Formula: C22H29ClN4O2 MolecularWeight: 416.94426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1C2=CC(=CC=C2)Cl)CC(C)C)C(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

CCC1=C(C(=NN1C2=CC(=CC=C2)Cl)CC(C)C)C(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H29ClN4O2/c1-5-20-21(22(29)26-11-9-25(10-12-26)16(4)28)19(13-15(2)3)24-27(20)18-8-6-7-17(23)14-18/h6-8,14-15H,5,9-13H2,1-4H3