N-(4-isoquinolin-5-ylphenyl)-4-morpholin-4-yl-3-(trifluoromethyl)benzamide

Systemtic Name: N-(4-isoquinolin-5-ylphenyl)-4-morpholin-4-yl-3-(trifluoromethyl)benzamide Openeye Name: N-[4-(5-isoquinolyl)phenyl]-4-morpholino-3-(trifluoromethyl)benzamide CAS Name: N-[4-(5-isoquinolinyl)phenyl]-4-(4-morpholinyl)-3-(trifluoromethyl)benzamide IUPAC Name: N-(4-isoquinolin-5-ylphenyl)-4-morpholin-4-yl-3-(trifluoromethyl)benzamide Traditional Name: N-[4-(5-isoquinolyl)phenyl]-4-morpholino-3-(trifluoromethyl)benzamide Formula: C27H22F3N3O2 MolecularWeight: 477.47769

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC5=C4C=CN=C5)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC5=C4C=CN=C5)C(F)(F)F

InChI

InChI=1S/C27H22F3N3O2/c28-27(29,30)24-16-19(6-9-25(24)33-12-14-35-15-13-33)26(34)32-21-7-4-18(5-8-21)22-3-1-2-20-17-31-11-10-23(20)22/h1-11,16-17H,12-15H2,(H,32,34)