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1-isoquinolin-5-yl-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea

1-isoquinolin-5-yl-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea

Systemtic Name:1-isoquinolin-5-yl-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea
Openeye Name:1-(5-isoquinolyl)-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea
CAS Name:1-(5-isoquinolinyl)-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea
IUPAC Name:1-isoquinolin-5-yl-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea
Traditional Name:1-(5-isoquinolyl)-3-[3-phenyl-2-[4-(trifluoromethyl)phenyl]propyl]urea
Formula: C26H22F3N3O
MolecularWeight: 449.46759
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CNC(=O)NC2=CC=CC3=C2C=CN=C3)C4=CC=C(C=C4)C(F)(F)F


Isomeric SMILES

C1=CC=C(C=C1)CC(CNC(=O)NC2=CC=CC3=C2C=CN=C3)C4=CC=C(C=C4)C(F)(F)F


InChI

InChI=1S/C26H22F3N3O/c27-26(28,29)22-11-9-19(10-12-22)21(15-18-5-2-1-3-6-18)17-31-25(33)32-24-8-4-7-20-16-30-14-13-23(20)24/h1-14,16,21H,15,17H2,(H2,31,32,33)


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