1-(pyridin-4-ylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(pyridin-4-ylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-(4-pyridylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-(pyridin-4-ylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine IUPAC Name: 1-(pyridin-4-ylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-(4-pyridylmethyl)-4-[4-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C17H18F3N3O2S MolecularWeight: 385.40393

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H18F3N3O2S/c18-17(19,20)15-1-3-16(4-2-15)26(24,25)23-11-9-22(10-12-23)13-14-5-7-21-8-6-14/h1-8H,9-13H2