1-butyl-3,3-bis[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea

Systemtic Name: 1-butyl-3,3-bis[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-butyl-3,3-bis[2-chloro-5-(trifluoromethyl)phenyl]urea CAS Name: 1-butyl-3,3-bis[2-chloro-5-(trifluoromethyl)phenyl]-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-butyl-3,3-bis[2-chloro-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-benzyl-1-butyl-3,3-bis[2-chloro-5-(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=C(C=CC(=C2)C(F)(F)F)Cl)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

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

InChI

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