Chlorantraniliprole
| PubChem CID | 11271640 |
| Molecular Formula | C18H14BrCl2N5O2 |
| Structure |
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| Synonyms |
Chlorantraniliprole
500008-45-7 CHLOANTRANILIPROLE DPX-E2Y45 chlorantranilipole Rynaxpyr Rynaxypyr Chlorantraniliprole [ISO] UNII-622AK9DH9G 622AK9DH9G CHEBI:67113 HSDB 7877 CHEMBL399318 DTXSID2044345 3-bromo-N-(4-chloro-2-methyl-6-((methylamino)carbonyl)phenyl)-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 3-bromo-4-chloro-1-(3-chloro-2-pyridyl)-2'-methyl-6-(methylcarbamoyl)pyrazole-5'carboxanilide 3-bromo-N-(4-chloro-2-methyl-6-(methylcarbamoyl)phenyl)-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide 5-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloropyridin-2-yl)pyrazole-3-carboxamide 3-bromo-4'-chloro-1-(3-chloro-2-pyridyl)-2'-methyl-6'-(methylcarbamoyl)pyrazole-5-carboxanilide 3-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide 3-Bromo-N-[4-chloro-2-methyl-6-[(methylamino)carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 3-bromo-N-{4-chloro-2-methyl-6-[(methylamino)carbonyl]phenyl}-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 5-bromanyl-N-[4-chloranyl-2-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloranylpyridin-2-yl)pyrazole-3-carboxamide Coragen F0U SCHEMBL29551 CHLORANTRANILIPROLE [MI] DTXCID0024345 GLXC-15702 BCP12712 DKI 0001 BDBM50222771 MFCD11840831 AKOS015895788 DS-9084 USEPA/OPP Pesticide Code: 090100 1H-Pyrazole-5-carboxamide, 3-bromo-N- 3-bromo-4-chloro-1-(3-chloro-2-pyridyl)-2?-methyl-6-(methylcarbamoyl)pyrazole-5-carboxanilide 1ST20310-1000M DB-071077 HY-112820 CS-0065743 NS00002799 C18454 A827923 Chlorantraniliprole 100 microg/mL in Acetonitrile Q2301181 Chlorantraniliprole Solution in Methanol, 1000?g/mL Chlorantraniliprole, PESTANAL(R), analytical standard 3-bromo-N-[4-chloro-2-methyl-6- [(methylamino)carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 3-bromo-N-[4-chloro-2-methyl-6-[(methyl-amino)carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 3-bromo-N-[4-chloro-2-methyl-6-[(methylamino)-carbonyl]phenyl]-1-(3-chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide 3-Bromo-N-[4-chloro-2-methyl-6-[(methylamino)carbonyl]phenyl]-1-(3- chloro-2-pyridinyl)-1H-pyrazole-5-carboxamide Pesticide4_Chlorantraniliprole_C18H14BrCl2N5O2_3-Bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-1-(3-chloropyridin-2-yl)-1H-pyrazole-5-carboxamide |
Computed Descriptors
| IUPAC Name | 5-bromo-N-[4-chloro-2-methyl-6-(methylcarbamoyl)phenyl]-2-(3-chloropyridin-2-yl)pyrazole-3-carboxamide |
| SMILES | CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)Cl |
| Canonical SMILES | CC1=CC(=CC(=C1NC(=O)C2=CC(=NN2C3=C(C=CC=N3)Cl)Br)C(=O)NC)Cl |
| InChI | InChI=1S/C18H14BrCl2N5O2/c1-9-6-10(20)7-11(17(27)22-2)15(9)24-18(28)13-8-14(19)25-26(13)16-12(21)4-3-5-23-16/h3-8H,1-2H3,(H,22,27)(H,24,28) |
| InChIKey | PSOVNZZNOMJUBI-UHFFFAOYSA-N |
Computed Properties
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| Molecular Weight | 483.1 g/mol |
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 480.971 |
| Monoisotopic Mass | 480.971 |
| Topological Polar Surface Area | 88.9 |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 586 |
| 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 |