(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)prop-2-en-1-one Formula: C17H25ClN4O2 MolecularWeight: 352.859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCN(CC2)C(=O)C)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)N2CCN(CC2)C(=O)C)Cl)CC(C)C

InChI

InChI=1S/C17H25ClN4O2/c1-12(2)11-22-17(18)15(13(3)19-22)5-6-16(24)21-9-7-20(8-10-21)14(4)23/h5-6,12H,7-11H2,1-4H3/b6-5+