4-[3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]piperazin-2-one

Systemtic Name: 4-[3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]piperazin-2-one Openeye Name: 4-[3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]piperazin-2-one CAS Name: 4-[3-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-1-oxoprop-2-enyl]-2-piperazinone IUPAC Name: 4-[3-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]prop-2-enoyl]piperazin-2-one Traditional Name: 4-[3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]acryloyl]piperazin-2-one Formula: C17H16ClFN4O2 MolecularWeight: 362.785943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCNC(=O)C2)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)N2CCNC(=O)C2)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H16ClFN4O2/c1-11-14(6-7-16(25)22-9-8-20-15(24)10-22)17(18)23(21-11)13-4-2-12(19)3-5-13/h2-7H,8-10H2,1H3,(H,20,24)