1-phenyl-3-[[2-(2-phenylethynyl)phenyl]methyl]urea

Systemtic Name: 1-phenyl-3-[[2-(2-phenylethynyl)phenyl]methyl]urea Openeye Name: 1-phenyl-3-[[2-(2-phenylethynyl)phenyl]methyl]urea CAS Name: 1-phenyl-3-[[2-(2-phenylethynyl)phenyl]methyl]urea IUPAC Name: 1-phenyl-3-[[2-(2-phenylethynyl)phenyl]methyl]urea Traditional Name: 1-phenyl-3-[2-(2-phenylethynyl)benzyl]urea Formula: C22H18N2O MolecularWeight: 326.39112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=CC=C2CNC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=CC=C2CNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H18N2O/c25-22(24-21-13-5-2-6-14-21)23-17-20-12-8-7-11-19(20)16-15-18-9-3-1-4-10-18/h1-14H,17H2,(H2,23,24,25)