1-isoquinolin-5-yl-3-[2-[4-(trifluoromethyloxy)phenyl]ethyl]urea

Systemtic Name: 1-isoquinolin-5-yl-3-[2-[4-(trifluoromethyloxy)phenyl]ethyl]urea Openeye Name: 1-(5-isoquinolyl)-3-[2-[4-(trifluoromethoxy)phenyl]ethyl]urea CAS Name: 1-(5-isoquinolinyl)-3-[2-[4-(trifluoromethoxy)phenyl]ethyl]urea IUPAC Name: 1-isoquinolin-5-yl-3-[2-[4-(trifluoromethoxy)phenyl]ethyl]urea Traditional Name: 1-(5-isoquinolyl)-3-[2-[4-(trifluoromethoxy)phenyl]ethyl]urea Formula: C19H16F3N3O2 MolecularWeight: 375.34445

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCCC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)NCCC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H16F3N3O2/c20-19(21,22)27-15-6-4-13(5-7-15)8-11-24-18(26)25-17-3-1-2-14-12-23-10-9-16(14)17/h1-7,9-10,12H,8,11H2,(H2,24,25,26)