4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-N-(2-pyridin-4-ylethyl)-7-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-N-(2-pyridin-4-ylethyl)-7-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-N-[2-(4-pyridyl)ethyl]-7-(trifluoromethyl)quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-N-(2-pyridin-4-ylethyl)-7-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-N-(2-pyridin-4-ylethyl)-7-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-N-[2-(4-pyridyl)ethyl]-7-(trifluoromethyl)quinoline-3-carboxamide Formula: C26H22ClF3N4O2 MolecularWeight: 514.92669

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C3C=CC(=CC3=NC=C2C(=O)NCCC4=CC=NC=C4)C(F)(F)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C3C=CC(=CC3=NC=C2C(=O)NCCC4=CC=NC=C4)C(F)(F)F)Cl

InChI

InChI=1S/C26H22ClF3N4O2/c1-36-23-5-2-17(12-21(23)27)14-34-24-19-4-3-18(26(28,29)30)13-22(19)33-15-20(24)25(35)32-11-8-16-6-9-31-10-7-16/h2-7,9-10,12-13,15H,8,11,14H2,1H3,(H,32,35)(H,33,34)