2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]nicotinonitrile Formula: C16H13ClF3N5 MolecularWeight: 367.75613

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C16H13ClF3N5/c17-13-8-12(16(18,19)20)10-23-15(13)25-6-4-24(5-7-25)14-11(9-21)2-1-3-22-14/h1-3,8,10H,4-7H2