[3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)piperazin-1-yl]methanone

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)piperazin-1-yl]methanone Openeye Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)piperazin-1-yl]methanone CAS Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[3-(1-pyrazolyl)propyl]-1-piperazinyl]methanone IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)piperazin-1-yl]methanone Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-[2-(3,4-dimethylbenzyl)-4-(3-pyrazol-1-ylpropyl)piperazino]methanone Formula: C28H30F6N4O MolecularWeight: 552.554419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2CN(CCN2C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CCCN4C=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2CN(CCN2C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CCCN4C=CC=N4)C

InChI

InChI=1S/C28H30F6N4O/c1-19-5-6-21(13-20(19)2)14-25-18-36(8-4-10-37-9-3-7-35-37)11-12-38(25)26(39)22-15-23(27(29,30)31)17-24(16-22)28(32,33)34/h3,5-7,9,13,15-17,25H,4,8,10-12,14,18H2,1-2H3