1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenyl-urea

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenyl-urea Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenyl-urea CAS Name: 1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenylurea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenylurea Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dichlorophenyl)-1-phenyl-urea Formula: C16H13Cl2N3O MolecularWeight: 334.19992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13Cl2N3O/c17-14-8-7-12(11-15(14)18)20-16(22)21(10-4-9-19)13-5-2-1-3-6-13/h1-3,5-8,11H,4,10H2,(H,20,22)