1-[(4-butylphenyl)methyl]-1-(3,3-dimethylbutyl)-3-[2,4,6-tris(chloranyl)phenyl]urea

Systemtic Name: 1-[(4-butylphenyl)methyl]-1-(3,3-dimethylbutyl)-3-[2,4,6-tris(chloranyl)phenyl]urea Openeye Name: 1-[(4-butylphenyl)methyl]-1-(3,3-dimethylbutyl)-3-(2,4,6-trichlorophenyl)urea CAS Name: 1-[(4-butylphenyl)methyl]-1-(3,3-dimethylbutyl)-3-(2,4,6-trichlorophenyl)urea IUPAC Name: 1-[(4-butylphenyl)methyl]-1-(3,3-dimethylbutyl)-3-(2,4,6-trichlorophenyl)urea Traditional Name: 1-(4-butylbenzyl)-1-(3,3-dimethylbutyl)-3-(2,4,6-trichlorophenyl)urea Formula: C24H31Cl3N2O MolecularWeight: 469.87474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CN(CCC(C)(C)C)C(=O)NC2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)CN(CCC(C)(C)C)C(=O)NC2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C24H31Cl3N2O/c1-5-6-7-17-8-10-18(11-9-17)16-29(13-12-24(2,3)4)23(30)28-22-20(26)14-19(25)15-21(22)27/h8-11,14-15H,5-7,12-13,16H2,1-4H3,(H,28,30)