PubChem CID | 115224 |
Molecular Formula | C10H9ClN4S |
Structure |
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Synonyms |
Thiacloprid
111988-49-9 Calypso (3-((6-Chloro-3-pyridinyl)methyl)-2-thiazolidinylidene)cyanamide (Z)-thiacloprid [3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]cyanamide CHEMBL451432 DSV3A944A4 1119449-18-1 DTXSID7034961 CHEBI:39176 {(2Z)-3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene}cyanamide [3-(6-Chloro-3-pyridinylmethyl)-2-thiazolidinylidene]cyanamide {3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene}cyanamide Cyanamide, [3-[(6-chloro-3-pyridinyl)methyl]-2-thiazolidinylidene]- ({3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene}amino)formonitrile Calypso 70WG [3-[(6-chloro-3-pyridinyl)methyl]-2-thiazolidinylidene]cyanamide Thiacloprid [ISO:BSI] (Z)-3-(6-chloro-3-pyridylmethyl)-1,3-thiazolidin-2-ylidenecyanamide Cyanamide, (3-((6-chloro-3-pyridinyl)methyl)-2-thiazolidinylidene)- N-(3-((6-Chloropyridin-3-yl)methyl)thiazolidin-2-ylidene)cyanamide HSDB 7268 UNII-DSV3A944A4 (E)-thiacloprid THIACLOPRID [MI] THIACLOPRID [ISO] THIACLOPRID [HSDB] SCHEMBL26490 SCHEMBL26491 SCHEMBL237347 DTXCID5014961 CHEBI:39175 DTXSID60861210 3c84 HOKKPVIRMVDYPB-UHFFFAOYSA-N HOKKPVIRMVDYPB-UVTDQMKNSA-N 3-((6-chloro-3-pyridinyl)methyl)-2-thiazolidinylidene cyanamide HY-B1953 Tox21_300697 BDBM50251868 MFCD09028056 AKOS015897524 DB08620 NCGC00164441-01 NCGC00164441-02 NCGC00164441-03 NCGC00164441-04 NCGC00254605-01 1ST20335 AS-35094 Thiacloprid 10 microg/mL in Acetonitrile DB-017476 CAS-111988-49-9 CS-0014056 NS00000448 T2967 C18512 Thiacloprid, PESTANAL(R), analytical standard A802461 EN300-11689967 Q416283 J-002682 Q63408702 Thiacloprid, certified reference material, TraceCERT(R) Z2044749895 (E)-N-(3-((6-chloropyridin-3-yl)methyl)thiazolidin-2-ylidene)cyanamide [3-[(6-chloranylpyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]cyanamide N-(3-(6-chloro-pyridin-3-ylmethyl)-thiazolidin-2-ylidene)-cyanamide (Z)-(3-((6-CHLORO-3-PYRIDINYL)METHYL)-2-THIAZOLIDINYLIDENE)CYANAMIDE |
IUPAC Name | [3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene]cyanamide |
SMILES | C1CSC(=NC#N)N1CC2=CN=C(C=C2)Cl |
Canonical SMILES | C1CSC(=NC#N)N1CC2=CN=C(C=C2)Cl |
InChI | InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2 |
InChIKey | HOKKPVIRMVDYPB-UHFFFAOYSA-N |
Molecular Weight | 252.72 g/mol |
XLogP3 | 2.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 252.024 |
Monoisotopic Mass | 252.024 |
Topological Polar Surface Area | 77.6 |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 324 |
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 |
---|---|---|---|
Aphis gossypii | CYP6CY13 | X | |
Aphis gossypii | CYP6CY22 | X | |
Apis mellifera | CYP9Q3 | D,X | |
Bombus terrestris | CYP9Q4 | D,X | |
Bombus terrestris | CYP9Q5 | D,X | |
Myzus persicae | CYP6CY3 | R | |
Nilaparvata lugens | CYP6ER1 | E | |
Osmia bicornis | CYP9BU1 | X | |
Osmia bicornis | CYP9BU2 | X |