1-[4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]carbonyl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 1-[4-[[3-(2,4-dimethylphenyl)-1H-pyrazol-5-yl]-oxomethyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 1-[4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 1-[4-[3-(2,4-dimethylphenyl)-1H-pyrazole-5-carbonyl]piperazino]-3-methyl-butan-1-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)CC(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NNC(=C2)C(=O)N3CCN(CC3)C(=O)CC(C)C)C

InChI

InChI=1S/C21H28N4O2/c1-14(2)11-20(26)24-7-9-25(10-8-24)21(27)19-13-18(22-23-19)17-6-5-15(3)12-16(17)4/h5-6,12-14H,7-11H2,1-4H3,(H,22,23)