1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-1,3-dimethyl-3-(3-propan-2-yloxyphenyl)urea

Systemtic Name: 1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-1,3-dimethyl-3-(3-propan-2-yloxyphenyl)urea Openeye Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-3-(3-isopropoxyphenyl)-1,3-dimethyl-urea CAS Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-1,3-dimethyl-3-(3-propan-2-yloxyphenyl)urea IUPAC Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-1,3-dimethyl-3-(3-propan-2-yloxyphenyl)urea Traditional Name: 1-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-3-(3-isopropoxyphenyl)-1,3-dimethyl-urea Formula: C29H30ClN3O3 MolecularWeight: 504.0198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)N(C)C(=O)N(C)CC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)N(C)C(=O)N(C)CC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

InChI

InChI=1S/C29H30ClN3O3/c1-19(2)36-23-13-9-12-22(17-23)32(4)29(35)31(3)18-26-27(20-10-7-6-8-11-20)25-16-21(30)14-15-24(25)28(34)33(26)5/h6-17,19H,18H2,1-5H3