3-(2-cyano-1,1-diphenyl-ethyl)-1,1-diphenyl-urea

Systemtic Name: 3-(2-cyano-1,1-diphenyl-ethyl)-1,1-diphenyl-urea Openeye Name: 3-(2-cyano-1,1-diphenyl-ethyl)-1,1-diphenyl-urea CAS Name: 3-(2-cyano-1,1-diphenylethyl)-1,1-diphenylurea IUPAC Name: 3-(2-cyano-1,1-diphenylethyl)-1,1-diphenylurea Traditional Name: 3-(2-cyano-1,1-diphenyl-ethyl)-1,1-diphenyl-urea Formula: C28H23N3O MolecularWeight: 417.50172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC#N)(C2=CC=CC=C2)NC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC#N)(C2=CC=CC=C2)NC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H23N3O/c29-22-21-28(23-13-5-1-6-14-23,24-15-7-2-8-16-24)30-27(32)31(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20H,21H2,(H,30,32)