3-[2,4-bis(fluoranyl)phenyl]-1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]urea Openeye Name: 1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-3-(2,4-difluorophenyl)urea CAS Name: 1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-3-(2,4-difluorophenyl)urea IUPAC Name: 1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-3-(2,4-difluorophenyl)urea Traditional Name: 1-[4-(2-chlorophenyl)-6,8-dimethyl-4H-quinolin-1-yl]-1-(3,5-ditert-butyl-4-hydroxy-benzyl)-3-(2,4-difluorophenyl)urea Formula: C39H42ClF2N3O2 MolecularWeight: 658.219486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(C=CN2N(CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC4=C(C=C(C=C4)F)F)C5=CC=CC=C5Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(C=CN2N(CC3=CC(=C(C(=C3)C(C)(C)C)O)C(C)(C)C)C(=O)NC4=C(C=C(C=C4)F)F)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C39H42ClF2N3O2/c1-23-17-24(2)35-29(18-23)27(28-11-9-10-12-32(28)40)15-16-44(35)45(37(47)43-34-14-13-26(41)21-33(34)42)22-25-19-30(38(3,4)5)36(46)31(20-25)39(6,7)8/h9-21,27,46H,22H2,1-8H3,(H,43,47)