1-(5-chloranyl-2,4-dimethoxy-phenyl)-1-methyl-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea

Systemtic Name: 1-(5-chloranyl-2,4-dimethoxy-phenyl)-1-methyl-3-[2-(2-methylpropyl)-1-oxidanylidene-isoquinolin-4-yl]urea Openeye Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-(2-isobutyl-1-oxo-4-isoquinolyl)-1-methyl-urea CAS Name: 1-(5-chloro-2,4-dimethoxyphenyl)-1-methyl-3-[2-(2-methylpropyl)-1-oxo-4-isoquinolinyl]urea IUPAC Name: 1-(5-chloro-2,4-dimethoxyphenyl)-1-methyl-3-[2-(2-methylpropyl)-1-oxoisoquinolin-4-yl]urea Traditional Name: 1-(5-chloro-2,4-dimethoxy-phenyl)-3-(2-isobutyl-1-keto-4-isoquinolyl)-1-methyl-urea Formula: C23H26ClN3O4 MolecularWeight: 443.92324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=CC=CC=C2C1=O)NC(=O)N(C)C3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CC(C)CN1C=C(C2=CC=CC=C2C1=O)NC(=O)N(C)C3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C23H26ClN3O4/c1-14(2)12-27-13-18(15-8-6-7-9-16(15)22(27)28)25-23(29)26(3)19-10-17(24)20(30-4)11-21(19)31-5/h6-11,13-14H,12H2,1-5H3,(H,25,29)