1-[2,6-bis(fluoranyl)phenyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-[2,6-bis(fluoranyl)phenyl]-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-(2,6-difluorophenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-(2,6-difluorophenyl)-3-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-(2,6-difluorophenyl)-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-(2,6-difluorophenyl)-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C19H19F2N3O2 MolecularWeight: 359.369866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=C(C=CC=C3F)F

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC3=C(C=CC=C3F)F

InChI

InChI=1S/C19H19F2N3O2/c1-2-17(25)24-9-8-12-6-7-14(10-13(12)11-24)22-19(26)23-18-15(20)4-3-5-16(18)21/h3-7,10H,2,8-9,11H2,1H3,(H2,22,23,26)