1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-[3-(1-imidazolyl)propyl]-1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(3-imidazol-1-ylpropyl)-1-(pyridin-4-ylmethyl)-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)-3-[3-(trifluoromethyl)phenyl]urea Formula: C20H20F3N5O MolecularWeight: 403.40091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)N(CCCN2C=CN=C2)CC3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)N(CCCN2C=CN=C2)CC3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N5O/c21-20(22,23)17-3-1-4-18(13-17)26-19(29)28(14-16-5-7-24-8-6-16)11-2-10-27-12-9-25-15-27/h1,3-9,12-13,15H,2,10-11,14H2,(H,26,29)