3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)urea Openeye Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)urea CAS Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridinylmethyl)urea IUPAC Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)urea Traditional Name: 3-(4-chlorophenyl)-1-(2-cyanoethyl)-1-(3-pyridylmethyl)urea Formula: C16H15ClN4O MolecularWeight: 314.7695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CCC#N)C(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CN=C1)CN(CCC#N)C(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClN4O/c17-14-4-6-15(7-5-14)20-16(22)21(10-2-8-18)12-13-3-1-9-19-11-13/h1,3-7,9,11H,2,10,12H2,(H,20,22)