3-(4-chlorophenyl)-1-(2-cyano-3-oxidanyl-3-phenyl-propyl)-1-(phenylmethyl)urea

Systemtic Name: 3-(4-chlorophenyl)-1-(2-cyano-3-oxidanyl-3-phenyl-propyl)-1-(phenylmethyl)urea Openeye Name: 1-benzyl-3-(4-chlorophenyl)-1-(2-cyano-3-hydroxy-3-phenyl-propyl)urea CAS Name: 3-(4-chlorophenyl)-1-(2-cyano-3-hydroxy-3-phenylpropyl)-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-(4-chlorophenyl)-1-(2-cyano-3-hydroxy-3-phenylpropyl)urea Traditional Name: 1-benzyl-3-(4-chlorophenyl)-1-(2-cyano-3-hydroxy-3-phenyl-propyl)urea Formula: C24H22ClN3O2 MolecularWeight: 419.90338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC(C#N)C(C2=CC=CC=C2)O)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CC(C#N)C(C2=CC=CC=C2)O)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H22ClN3O2/c25-21-11-13-22(14-12-21)27-24(30)28(16-18-7-3-1-4-8-18)17-20(15-26)23(29)19-9-5-2-6-10-19/h1-14,20,23,29H,16-17H2,(H,27,30)