2-piperazin-1-yl-N-(1H-1,2,4-triazol-5-yl)-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine

Systemtic Name: 2-piperazin-1-yl-N-(1H-1,2,4-triazol-5-yl)-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine Openeye Name: 2-piperazin-1-yl-N-(1H-1,2,4-triazol-5-yl)-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine CAS Name: 2-(1-piperazinyl)-N-(1H-1,2,4-triazol-5-yl)-6-[2-(trifluoromethyl)phenyl]-4-pyridinamine IUPAC Name: 2-piperazin-1-yl-N-(1H-1,2,4-triazol-5-yl)-6-[2-(trifluoromethyl)phenyl]pyridin-4-amine Traditional Name: [2-piperazino-6-[2-(trifluoromethyl)phenyl]-4-pyridyl]-(1H-1,2,4-triazol-5-yl)amine Formula: C18H18F3N7 MolecularWeight: 389.37763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=CC(=N2)C3=CC=CC=C3C(F)(F)F)NC4=NC=NN4

Isomeric SMILES

C1CN(CCN1)C2=CC(=CC(=N2)C3=CC=CC=C3C(F)(F)F)NC4=NC=NN4

InChI

InChI=1S/C18H18F3N7/c19-18(20,21)14-4-2-1-3-13(14)15-9-12(25-17-23-11-24-27-17)10-16(26-15)28-7-5-22-6-8-28/h1-4,9-11,22H,5-8H2,(H2,23,24,25,26,27)