1-[1-[3-fluoranyl-4-(trifluoromethyl)phenyl]ethyl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[1-[3-fluoranyl-4-(trifluoromethyl)phenyl]ethyl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]-3-(5-isoquinolyl)urea CAS Name: 1-[1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]-3-isoquinolin-5-ylurea Traditional Name: 1-[1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]-3-(5-isoquinolyl)urea Formula: C19H15F4N3O MolecularWeight: 377.335513

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C(F)(F)F)F)NC(=O)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(C1=CC(=C(C=C1)C(F)(F)F)F)NC(=O)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H15F4N3O/c1-11(12-5-6-15(16(20)9-12)19(21,22)23)25-18(27)26-17-4-2-3-13-10-24-8-7-14(13)17/h2-11H,1H3,(H2,25,26,27)