1-[4-[1-(2-cyanoethylamino)ethyl]phenyl]urea

Systemtic Name: 1-[4-[1-(2-cyanoethylamino)ethyl]phenyl]urea Openeye Name: [4-[1-(2-cyanoethylamino)ethyl]phenyl]urea CAS Name: [4-[1-(2-cyanoethylamino)ethyl]phenyl]urea IUPAC Name: [4-[1-(2-cyanoethylamino)ethyl]phenyl]urea Traditional Name: [4-[1-(2-cyanoethylamino)ethyl]phenyl]urea Formula: C12H16N4O MolecularWeight: 232.28164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4O/c1-9(15-8-2-7-13)10-3-5-11(6-4-10)16-12(14)17/h3-6,9,15H,2,8H2,1H3,(H3,14,16,17)