1-[3,4-bis(fluoranyl)phenyl]-3-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]urea

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]-3-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]urea Openeye Name: 1-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]-3-(3,4-difluorophenyl)urea CAS Name: 1-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]-3-(3,4-difluorophenyl)urea IUPAC Name: 1-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]-3-(3,4-difluorophenyl)urea Traditional Name: 1-[2-[4-(3-cyanophenyl)phenyl]-4-(dimethylamino)butyl]-3-(3,4-difluorophenyl)urea Formula: C26H26F2N4O MolecularWeight: 448.507646

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(CNC(=O)NC1=CC(=C(C=C1)F)F)C2=CC=C(C=C2)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN(C)CCC(CNC(=O)NC1=CC(=C(C=C1)F)F)C2=CC=C(C=C2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C26H26F2N4O/c1-32(2)13-12-22(17-30-26(33)31-23-10-11-24(27)25(28)15-23)20-8-6-19(7-9-20)21-5-3-4-18(14-21)16-29/h3-11,14-15,22H,12-13,17H2,1-2H3,(H2,30,31,33)