1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]urea hydrochloride

Systemtic Name: 1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]urea hydrochloride Openeye Name: (6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methylurea hydrochloride CAS Name: (6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methylurea hydrochloride IUPAC Name: (6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methylurea hydrochloride Traditional Name: (6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methylurea hydrochloride Formula: C18H17Cl2N3O2 MolecularWeight: 378.25248

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CNC(=O)N.Cl

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CNC(=O)N.Cl

InChI

InChI=1S/C18H16ClN3O2.ClH/c1-22-15(10-21-18(20)24)16(11-5-3-2-4-6-11)14-9-12(19)7-8-13(14)17(22)23;/h2-9H,10H2,1H3,(H3,20,21,24);1H