1-methyl-3-[1-oxidanylidene-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]urea

Systemtic Name: 1-methyl-3-[1-oxidanylidene-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]urea Openeye Name: 1-methyl-3-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]urea CAS Name: 1-methyl-3-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]urea IUPAC Name: 1-methyl-3-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]urea Traditional Name: 1-[1-keto-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]-3-methyl-urea Formula: C18H14F3N3O2 MolecularWeight: 361.31787

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CNC(=O)NC1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H14F3N3O2/c1-22-17(26)23-11-7-6-10-8-15(24-16(25)13(10)9-11)12-4-2-3-5-14(12)18(19,20)21/h2-9H,1H3,(H,24,25)(H2,22,23,26)