N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]quinoline-5-carboxamide

Systemtic Name: N-[2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]quinoline-5-carboxamide Openeye Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]quinoline-5-carboxamide CAS Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-5-quinolinecarboxamide IUPAC Name: N-[2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]amino]ethyl]quinoline-5-carboxamide Traditional Name: N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]amino]ethyl]quinoline-5-carboxamide Formula: C18H14ClF3N4O MolecularWeight: 394.77817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CC=NC2=C1)C(=O)NCCNC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C2C=CC=NC2=C1)C(=O)NCCNC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C18H14ClF3N4O/c19-14-9-11(18(20,21)22)10-26-16(14)24-7-8-25-17(27)13-3-1-5-15-12(13)4-2-6-23-15/h1-6,9-10H,7-8H2,(H,24,26)(H,25,27)