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

Systemtic Name: 1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-3-[3-(2-dimethylaminoethyloxy)phenyl]urea Openeye Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-3-[3-(2-dimethylaminoethyloxy)phenyl]urea CAS Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-3-[3-(2-dimethylaminoethyloxy)phenyl]urea IUPAC Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-3-[3-(2-dimethylaminoethyloxy)phenyl]urea Traditional Name: 1-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-3-[3-(2-dimethylaminoethyloxy)phenyl]urea Formula: C28H29ClN4O3 MolecularWeight: 505.00786

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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)NC4=CC(=CC=C4)OCCN(C)C

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CNC(=O)NC4=CC(=CC=C4)OCCN(C)C

InChI

InChI=1S/C28H29ClN4O3/c1-32(2)14-15-36-22-11-7-10-21(17-22)31-28(35)30-18-25-26(19-8-5-4-6-9-19)24-16-20(29)12-13-23(24)27(34)33(25)3/h4-13,16-17H,14-15,18H2,1-3H3,(H2,30,31,35)