1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-3-phenyl-urea; N,N-dimethylmethanamine

Systemtic Name: 1-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-3-phenyl-urea; N,N-dimethylmethanamine Openeye Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-3-phenyl-urea; N,N-dimethylmethanamine CAS Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-3-phenylurea; N,N-dimethylmethanamine IUPAC Name: 1-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-3-phenylurea; N,N-dimethylmethanamine Traditional Name: 1-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-3-phenyl-urea; trimethylamine Formula: C27H29ClN4O2 MolecularWeight: 476.99776

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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.CN(C)C

Isomeric SMILES

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

InChI

InChI=1S/C24H20ClN3O2.C3H9N/c1-28-21(15-26-24(30)27-18-10-6-3-7-11-18)22(16-8-4-2-5-9-16)20-14-17(25)12-13-19(20)23(28)29;1-4(2)3/h2-14H,15H2,1H3,(H2,26,27,30);1-3H3