1-[4-[4-[1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazol-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[1-(3-chloranyl-4-methyl-phenyl)-5-cyclopropyl-pyrazol-4-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[1-(3-chloro-4-methylphenyl)-5-cyclopropyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[1-(3-chloro-4-methylphenyl)-5-cyclopropylpyrazole-4-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[1-(3-chloro-4-methyl-phenyl)-5-cyclopropyl-pyrazole-4-carbonyl]piperazino]phenyl]ethanone Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5CC5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=C(C=N2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C5CC5)Cl

InChI

InChI=1S/C26H27ClN4O2/c1-17-3-8-22(15-24(17)27)31-25(20-4-5-20)23(16-28-31)26(33)30-13-11-29(12-14-30)21-9-6-19(7-10-21)18(2)32/h3,6-10,15-16,20H,4-5,11-14H2,1-2H3