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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20F3N3O2/c22-21(23,24)16-4-7-17(8-5-16)25-20(29)26-18-6-3-13-9-10-27(12-15(13)11-18)19(28)14-1-2-14/h3-8,11,14H,1-2,9-10,12H2,(H2,25,26,29)