1-(2-cyanoethyl)-3-phenyl-1-[3-[phenyl(phenylcarbamoyl)amino]propyl]urea

Systemtic Name: 1-(2-cyanoethyl)-3-phenyl-1-[3-[phenyl(phenylcarbamoyl)amino]propyl]urea Openeye Name: 1-(2-cyanoethyl)-3-phenyl-1-[3-[N-(phenylcarbamoyl)anilino]propyl]urea CAS Name: 1-[3-(N-[anilino(oxo)methyl]anilino)propyl]-1-(2-cyanoethyl)-3-phenylurea IUPAC Name: 1-(2-cyanoethyl)-3-phenyl-1-[3-[N-(phenylcarbamoyl)anilino]propyl]urea Traditional Name: 1-(2-cyanoethyl)-3-phenyl-1-[3-[N-(phenylcarbamoyl)anilino]propyl]urea Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)N(CCCN(C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)N(CCCN(C2=CC=CC=C2)C(=O)NC3=CC=CC=C3)CCC#N

InChI

InChI=1S/C26H27N5O2/c27-18-10-19-30(25(32)28-22-12-4-1-5-13-22)20-11-21-31(24-16-8-3-9-17-24)26(33)29-23-14-6-2-7-15-23/h1-9,12-17H,10-11,19-21H2,(H,28,32)(H,29,33)