1-[(2-chlorophenyl)methyl]-3-[4-(4-fluoranyl-2-methyl-phenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]urea

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3-[4-(4-fluoranyl-2-methyl-phenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]urea Openeye Name: 1-[(2-chlorophenyl)methyl]-3-[4-(4-fluoro-2-methyl-phenyl)-2-methyl-1-oxo-3-isoquinolyl]urea CAS Name: 1-[(2-chlorophenyl)methyl]-3-[4-(4-fluoro-2-methylphenyl)-2-methyl-1-oxo-3-isoquinolinyl]urea IUPAC Name: 1-[(2-chlorophenyl)methyl]-3-[4-(4-fluoro-2-methylphenyl)-2-methyl-1-oxoisoquinolin-3-yl]urea Traditional Name: 1-(2-chlorobenzyl)-3-[4-(4-fluoro-2-methyl-phenyl)-1-keto-2-methyl-3-isoquinolyl]urea Formula: C25H21ClFN3O2 MolecularWeight: 449.904543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)C2=C(N(C(=O)C3=CC=CC=C32)C)NC(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C(C=CC(=C1)F)C2=C(N(C(=O)C3=CC=CC=C32)C)NC(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C25H21ClFN3O2/c1-15-13-17(27)11-12-18(15)22-19-8-4-5-9-20(19)24(31)30(2)23(22)29-25(32)28-14-16-7-3-6-10-21(16)26/h3-13H,14H2,1-2H3,(H2,28,29,32)