3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propan-1-one CAS Name: 3-[5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propan-1-one Traditional Name: 1-(4-benzylpiperazino)-3-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]propan-1-one Formula: C21H25F3N4O MolecularWeight: 406.44461

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=NN2CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)C(F)(F)F

Isomeric SMILES

C1CC1C2=CC(=NN2CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O/c22-21(23,24)19-14-18(17-6-7-17)28(25-19)9-8-20(29)27-12-10-26(11-13-27)15-16-4-2-1-3-5-16/h1-5,14,17H,6-13,15H2