1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-isoquinolin-5-yl-urea

Systemtic Name: 1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-isoquinolin-5-yl-urea Openeye Name: 1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-(5-isoquinolyl)urea CAS Name: 1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-(5-isoquinolinyl)urea IUPAC Name: 1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-isoquinolin-5-ylurea Traditional Name: 1-[cyclopentyl-[4-(trifluoromethyl)phenyl]methyl]-3-(5-isoquinolyl)urea Formula: C23H22F3N3O MolecularWeight: 413.43549

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=C(C=C2)C(F)(F)F)NC(=O)NC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CCC(C1)C(C2=CC=C(C=C2)C(F)(F)F)NC(=O)NC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C23H22F3N3O/c24-23(25,26)18-10-8-16(9-11-18)21(15-4-1-2-5-15)29-22(30)28-20-7-3-6-17-14-27-13-12-19(17)20/h3,6-15,21H,1-2,4-5H2,(H2,28,29,30)