2-(benzotriazol-1-yl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]ethanone Formula: C18H17F3N6O MolecularWeight: 390.36239

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H17F3N6O/c19-18(20,21)13-5-6-16(22-11-13)25-7-9-26(10-8-25)17(28)12-27-15-4-2-1-3-14(15)23-24-27/h1-6,11H,7-10,12H2