1-(3-chloranyl-2-cyano-phenyl)-3-(2,4,4-trimethylpentan-2-yl)urea

Systemtic Name: 1-(3-chloranyl-2-cyano-phenyl)-3-(2,4,4-trimethylpentan-2-yl)urea Openeye Name: 1-(3-chloro-2-cyano-phenyl)-3-(1,1,3,3-tetramethylbutyl)urea CAS Name: 1-(3-chloro-2-cyanophenyl)-3-(2,4,4-trimethylpentan-2-yl)urea IUPAC Name: 1-(3-chloro-2-cyanophenyl)-3-(2,4,4-trimethylpentan-2-yl)urea Traditional Name: 1-(3-chloro-2-cyano-phenyl)-3-(1,1,3,3-tetramethylbutyl)urea Formula: C16H22ClN3O MolecularWeight: 307.81838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)NC(=O)NC1=C(C(=CC=C1)Cl)C#N

Isomeric SMILES

CC(C)(C)CC(C)(C)NC(=O)NC1=C(C(=CC=C1)Cl)C#N

InChI

InChI=1S/C16H22ClN3O/c1-15(2,3)10-16(4,5)20-14(21)19-13-8-6-7-12(17)11(13)9-18/h6-8H,10H2,1-5H3,(H2,19,20,21)