[4-(phenylmethyl)piperazin-1-yl]-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone Traditional Name: (4-benzylpiperazino)-[5-(trifluoromethyl)-1H-pyrazol-3-yl]methanone Formula: C16H17F3N4O MolecularWeight: 338.32759

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=NNC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=NNC(=C3)C(F)(F)F

InChI

InChI=1S/C16H17F3N4O/c17-16(18,19)14-10-13(20-21-14)15(24)23-8-6-22(7-9-23)11-12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,20,21)