4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]but-2-yn-1-amine

Systemtic Name: 4-[4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]but-2-yn-1-amine Openeye Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]but-2-yn-1-amine CAS Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]-2-butyn-1-amine IUPAC Name: 4-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]but-2-yn-1-amine Traditional Name: 4-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazino]but-2-ynylamine Formula: C14H16ClF3N4 MolecularWeight: 332.75185

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#CCN)C2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCN1CC#CCN)C2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C14H16ClF3N4/c15-12-9-11(14(16,17)18)10-20-13(12)22-7-5-21(6-8-22)4-2-1-3-19/h9-10H,3-8,19H2