1-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(2-cyclopropylcarbonyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-[2-[cyclopropyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-[2-(cyclopropanecarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[3-(trifluoromethyl)phenyl]urea Formula: C21H20F3N3O2 MolecularWeight: 403.39761

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CC1C(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H20F3N3O2/c22-21(23,24)16-2-1-3-17(11-16)25-20(29)26-18-7-6-13-8-9-27(12-15(13)10-18)19(28)14-4-5-14/h1-3,6-7,10-11,14H,4-5,8-9,12H2,(H2,25,26,29)