1-(2-chloranyl-4-methyl-phenyl)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)urea

Systemtic Name: 1-(2-chloranyl-4-methyl-phenyl)-3-(2-methyl-1-oxidanylidene-isoquinolin-4-yl)urea Openeye Name: 1-(2-chloro-4-methyl-phenyl)-3-(2-methyl-1-oxo-4-isoquinolyl)urea CAS Name: 1-(2-chloro-4-methylphenyl)-3-(2-methyl-1-oxo-4-isoquinolinyl)urea IUPAC Name: 1-(2-chloro-4-methylphenyl)-3-(2-methyl-1-oxoisoquinolin-4-yl)urea Traditional Name: 1-(2-chloro-4-methyl-phenyl)-3-(1-keto-2-methyl-4-isoquinolyl)urea Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC2=CN(C(=O)C3=CC=CC=C32)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC2=CN(C(=O)C3=CC=CC=C32)C)Cl

InChI

InChI=1S/C18H16ClN3O2/c1-11-7-8-15(14(19)9-11)20-18(24)21-16-10-22(2)17(23)13-6-4-3-5-12(13)16/h3-10H,1-2H3,(H2,20,21,24)