1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethane-1,2-dione

Systemtic Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethane-1,2-dione Openeye Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethane-1,2-dione CAS Name: 1-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]ethane-1,2-dione IUPAC Name: 1-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethane-1,2-dione Traditional Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(4-isobutyrylpiperazino)ethane-1,2-dione Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)C(=O)N3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C21H26N4O3/c1-14(2)20(27)23-10-12-24(13-11-23)21(28)19(26)18-15(3)22-25(16(18)4)17-8-6-5-7-9-17/h5-9,14H,10-13H2,1-4H3