1-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]-3-[(2-chloranyl-4,5-dicyano-phenyl)amino]urea

Systemtic Name: 1-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]-3-[(2-chloranyl-4,5-dicyano-phenyl)amino]urea Openeye Name: 1-[[2,4-bis(1,1-dimethylpropyl)phenoxy]methyl]-3-(2-chloro-4,5-dicyano-anilino)urea CAS Name: 1-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]-3-(2-chloro-4,5-dicyanoanilino)urea IUPAC Name: 1-[[2,4-bis(2-methylbutan-2-yl)phenoxy]methyl]-3-(2-chloro-4,5-dicyanoanilino)urea Traditional Name: 1-(2-chloro-4,5-dicyano-anilino)-3-[(2,4-ditert-amylphenoxy)methyl]urea Formula: C26H32ClN5O2 MolecularWeight: 482.01758

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCNC(=O)NNC2=C(C=C(C(=C2)C#N)C#N)Cl)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCNC(=O)NNC2=C(C=C(C(=C2)C#N)C#N)Cl)C(C)(C)CC

InChI

InChI=1S/C26H32ClN5O2/c1-7-25(3,4)19-9-10-23(20(13-19)26(5,6)8-2)34-16-30-24(33)32-31-22-12-18(15-29)17(14-28)11-21(22)27/h9-13,31H,7-8,16H2,1-6H3,(H2,30,32,33)