PubChem CID | 141746946 |
Molecular Formula | C28H17BrF12N2O2 |
Structure |
![]() |
Synonyms |
cyproflanilide
Cyproflanilide [ISO] 2375110-88-4 P3D8S42HA2 Benzamide, N-(3-(((2-bromo-4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-6-(trifluoromethyl)phenyl)amino)carbonyl)-2-fluorophenyl)-N-(cyclopropylmethyl)-4-fluoro- N-(3-(((2-Bromo-4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-6-(trifluoromethyl)phenyl)amino)carbonyl)-2-fluorophenyl)-N-(cyclopropylmethyl)-4-fluorobenzamide N-(3-((2-Bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl)carbamoyl)-2-fluorophenyl)-N-(cyclopropylmethyl)-4-fluorobenzamide N-[2-bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl]-3-[N-(cyclopropylmethyl)-4-fluorobenzamido]-2-fluorobenzamide 3'-((6-Bromo-alpha,alpha,alpha-trifluoro-4-(1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl)-o-tolyl)carbamoyl)-N-(cyclopropylmethyl)-2',4-difluorobenzanilide 3'-({6-bromo-alpha,alpha,alpha-trifluoro-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-o-tolyl}carbamoyl)-N-(cyclopropylmethyl)-2',4-difluorobenzanilide N-[3-[[[2-bromo-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-6-(trifluoromethyl)phenyl]amino]carbonyl]-2-fluorophenyl]-N-(cyclopropylmethyl)-4-fluorobenzamide UNII-P3D8S42HA2 SCHEMBL21705019 CAC-I-785 CHEBI:156471 WULALRGFFYJWOL-UHFFFAOYSA-N DTXSID601337337 NS00133947 EN300-28333670 3'-((6-BROMO-.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-4-(1,2,2,2-TETRAFLUORO-1-(TRIFLUOROMETHYL)ETHYL)-O-TOLYL)CARBAMOYL)-N-(CYCLOPROPYLMETHYL)-2',4-DIFLUOROBENZANILIDE N-[2-bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl]-3-[(cyclopropylmethyl)(4-fluorobenzoyl)amino]-2-fluorobenzamide |
IUPAC Name | N-[2-bromo-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-6-(trifluoromethyl)phenyl]-3-[cyclopropylmethyl-(4-fluorobenzoyl)amino]-2-fluorobenzamide |
SMILES | C1CC1CN(C2=CC=CC(=C2F)C(=O)NC3=C(C=C(C=C3Br)C(C(F)(F)F)(C(F)(F)F)F)C(F)(F)F)C(=O)C4=CC=C(C=C4)F |
Canonical SMILES | C1CC1CN(C2=CC=CC(=C2F)C(=O)NC3=C(C=C(C=C3Br)C(C(F)(F)F)(C(F)(F)F)F)C(F)(F)F)C(=O)C4=CC=C(C=C4)F |
InChI | InChI=1S/C28H17BrF12N2O2/c29-19-11-15(25(32,27(36,37)38)28(39,40)41)10-18(26(33,34)35)22(19)42-23(44)17-2-1-3-20(21(17)31)43(12-13-4-5-13)24(45)14-6-8-16(30)9-7-14/h1-3,6-11,13H,4-5,12H2,(H,42,44) |
InChIKey | WULALRGFFYJWOL-UHFFFAOYSA-N |
Molecular Weight | 721.3 g/mol |
XLogP3 | 8.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 14 |
Rotatable Bond Count | 7 |
Exact Mass | 720.028 |
Monoisotopic Mass | 720.028 |
Topological Polar Surface Area | 49.4 |
Heavy Atom Count | 45 |
Formal Charge | 0 |
Complexity | 1040 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Insect | Gene Symbol | Validation | Reference |
---|---|---|---|
Chilo suppressalis | CYP4AU10 | R | |
Chilo suppressalis | CYP4G90 | R | |
Spodoptera frugiperda | CYP321A9 | R |