3-(6,7-dimethyl-1-oxidanylidene-4-phenyl-2H-isoquinolin-3-yl)-1-methyl-1-(phenylmethyl)urea

Systemtic Name: 3-(6,7-dimethyl-1-oxidanylidene-4-phenyl-2H-isoquinolin-3-yl)-1-methyl-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(6,7-dimethyl-1-oxo-4-phenyl-2H-isoquinolin-3-yl)-1-methyl-urea CAS Name: 3-(6,7-dimethyl-1-oxo-4-phenyl-2H-isoquinolin-3-yl)-1-methyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(6,7-dimethyl-1-oxo-4-phenyl-2H-isoquinolin-3-yl)-1-methylurea Traditional Name: 1-benzyl-3-(1-keto-6,7-dimethyl-4-phenyl-2H-isoquinolin-3-yl)-1-methyl-urea Formula: C26H25N3O2 MolecularWeight: 411.4956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(NC2=O)NC(=O)N(C)CC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(NC2=O)NC(=O)N(C)CC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H25N3O2/c1-17-14-21-22(15-18(17)2)25(30)27-24(23(21)20-12-8-5-9-13-20)28-26(31)29(3)16-19-10-6-4-7-11-19/h4-15H,16H2,1-3H3,(H2,27,28,30,31)