1-butyl-3,3-bis[4-chloranyl-3-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea

Systemtic Name: 1-butyl-3,3-bis[4-chloranyl-3-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-butyl-3,3-bis[4-chloro-3-(trifluoromethyl)phenyl]urea CAS Name: 1-butyl-3,3-bis[4-chloro-3-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-butyl-3,3-bis[4-chloro-3-(trifluoromethyl)phenyl]urea Traditional Name: 1-benzyl-1-butyl-3,3-bis[4-chloro-3-(trifluoromethyl)phenyl]urea Formula: C26H22Cl2F6N2O MolecularWeight: 563.362099

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)C(=O)N(C2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)C(=O)N(C2=CC(=C(C=C2)Cl)C(F)(F)F)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C26H22Cl2F6N2O/c1-2-3-13-35(16-17-7-5-4-6-8-17)24(37)36(18-9-11-22(27)20(14-18)25(29,30)31)19-10-12-23(28)21(15-19)26(32,33)34/h4-12,14-15H,2-3,13,16H2,1H3