1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea

Systemtic Name: 1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea Openeye Name: 1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea CAS Name: 1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[2-[4-(3-cyanophenyl)phenyl]-4-(cyclopropylamino)butyl]urea Formula: C27H27ClN4O MolecularWeight: 458.98248

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NCCC(CNC(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC1NCCC(CNC(=O)NC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H27ClN4O/c28-24-5-2-6-26(16-24)32-27(33)31-18-23(13-14-30-25-11-12-25)21-9-7-20(8-10-21)22-4-1-3-19(15-22)17-29/h1-10,15-16,23,25,30H,11-14,18H2,(H2,31,32,33)