1-[4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[4-(4-fluorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-3-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-(4-fluorophenyl)-2-methyl-1-oxo-3-isoquinolyl]urea CAS Name: 1-[4-(4-fluorophenyl)-2-methyl-1-oxo-3-isoquinolinyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-(4-fluorophenyl)-2-methyl-1-oxoisoquinolin-3-yl]urea Traditional Name: 1-benzyl-3-[4-(4-fluorophenyl)-1-keto-2-methyl-3-isoquinolyl]urea Formula: C24H20FN3O2 MolecularWeight: 401.432903

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H20FN3O2/c1-28-22(27-24(30)26-15-16-7-3-2-4-8-16)21(17-11-13-18(25)14-12-17)19-9-5-6-10-20(19)23(28)29/h2-14H,15H2,1H3,(H2,26,27,30)