1,1-bis(2-cyanoethyl)-3-(4-ethanoylphenyl)urea

Systemtic Name: 1,1-bis(2-cyanoethyl)-3-(4-ethanoylphenyl)urea Openeye Name: 3-(4-acetylphenyl)-1,1-bis(2-cyanoethyl)urea CAS Name: 3-(4-acetylphenyl)-1,1-bis(2-cyanoethyl)urea IUPAC Name: 3-(4-acetylphenyl)-1,1-bis(2-cyanoethyl)urea Traditional Name: 3-(4-acetylphenyl)-1,1-bis(2-cyanoethyl)urea Formula: C15H16N4O2 MolecularWeight: 284.31314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C15H16N4O2/c1-12(20)13-4-6-14(7-5-13)18-15(21)19(10-2-8-16)11-3-9-17/h4-7H,2-3,10-11H2,1H3,(H,18,21)