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

Systemtic Name: 1-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-[3-(trifluoromethyl)phenyl]urea Formula: C20H20F3N3O2 MolecularWeight: 391.38691

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O2/c1-2-18(27)26-9-8-13-6-7-17(10-14(13)12-26)25-19(28)24-16-5-3-4-15(11-16)20(21,22)23/h3-7,10-11H,2,8-9,12H2,1H3,(H2,24,25,28)