3-(3-chlorophenyl)-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-phenethyl-urea

Systemtic Name: 3-(3-chlorophenyl)-1-[(7,8-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-1-phenethyl-urea Openeye Name: 3-(3-chlorophenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethyl-urea CAS Name: 3-(3-chlorophenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethylurea IUPAC Name: 3-(3-chlorophenyl)-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-1-phenethylurea Traditional Name: 3-(3-chlorophenyl)-1-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]-1-phenethyl-urea Formula: C27H26ClN3O2 MolecularWeight: 459.96724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CN(CCC3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C27H26ClN3O2/c1-18-11-12-21-15-22(26(32)30-25(21)19(18)2)17-31(14-13-20-7-4-3-5-8-20)27(33)29-24-10-6-9-23(28)16-24/h3-12,15-16H,13-14,17H2,1-2H3,(H,29,33)(H,30,32)