1-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)-3-(5-methylcyclohexa-2,4-dien-1-yl)urea

Systemtic Name: 1-(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)-3-(5-methylcyclohexa-2,4-dien-1-yl)urea Openeye Name: 1-(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)-3-(5-methylcyclohexa-2,4-dien-1-yl)urea CAS Name: 1-(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)-3-(5-methyl-1-cyclohexa-2,4-dienyl)urea IUPAC Name: 1-(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)-3-(5-methylcyclohexa-2,4-dien-1-yl)urea Traditional Name: 1-(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)-3-(5-methylcyclohexa-2,4-dien-1-yl)urea Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1)NC(=O)NC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(C1)NC(=O)NC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

InChI

InChI=1S/C24H22ClN3O2/c1-15-7-6-10-18(13-15)26-24(30)27-22-21(16-8-4-3-5-9-16)20-14-17(25)11-12-19(20)23(29)28(22)2/h3-12,14,18H,13H2,1-2H3,(H2,26,27,30)