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

Systemtic Name: 1-(2-cyano-3-oxidanyl-3-phenyl-propyl)-3-(3,4-dichlorophenyl)-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-(2-cyano-3-hydroxy-3-phenyl-propyl)-3-(3,4-dichlorophenyl)urea CAS Name: 1-(2-cyano-3-hydroxy-3-phenylpropyl)-3-(3,4-dichlorophenyl)-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-(2-cyano-3-hydroxy-3-phenylpropyl)-3-(3,4-dichlorophenyl)urea Traditional Name: 1-benzyl-1-(2-cyano-3-hydroxy-3-phenyl-propyl)-3-(3,4-dichlorophenyl)urea Formula: C24H21Cl2N3O2 MolecularWeight: 454.34844

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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)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)Cl

InChI

InChI=1S/C24H21Cl2N3O2/c25-21-12-11-20(13-22(21)26)28-24(31)29(15-17-7-3-1-4-8-17)16-19(14-27)23(30)18-9-5-2-6-10-18/h1-13,19,23,30H,15-16H2,(H,28,31)