EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:47665 - 5-(3,5-DICHLOROPHENYL)THIO-4-ISOPROPYL-1-(PYRIDIN-4-YL-METHYL)-1H-IMIDAZOL-2-YL-METHYL CARBAMATE

Default Structure
ChEBI IDCHEBI:47665
ChEBI Name5-(3,5-DICHLOROPHENYL)THIO-4-ISOPROPYL-1-(PYRIDIN-4-YL-METHYL)-1H-IMIDAZOL-2-YL-METHYL CARBAMATE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC20H20Cl2N4O2S
Net Charge0
Average Mass451.379
Monoisotopic Mass450.06840
SMILES[H]c1nc([H])c([H])c(C([H])([H])n2c(C([H])([H])OC(=O)N([H])[H])nc(C([H])(C([H])([H])[H])C([H])([H])[H])c2Sc2c([H])c(Cl)c([H])c(Cl)c2[H])c1[H]
InChIInChI=1S/C20H20Cl2N4O2S/c1-12(2)18-19(29-16-8-14(21)7-15(22)9-16)26(10-13-3-5-24-6-4-13)17(25-18)11-28-20(23)27/h3-9,12H,10-11H2,1-2H3,(H2,23,27)
InChIKeyYQXCVAGCMNFUMQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-(3,5-DICHLOROPHENYL)THIO-4-ISOPROPYL-1-(PYRIDIN-4-YL-METHYL)-1H-IMIDAZOL-2-YL-METHYL CARBAMATE (CHEBI:47665) is a unclassifieds (CHEBI:27189)
Synonyms  Source
{5-[(3,5-dichlorophenyl)sulfanyl]-4-(1-methylethyl)-1-(pyridin-4-ylmethyl)-1H-imidazol-2-yl}methyl carbamatePDBeChem
5-(3,5-DICHLOROPHENYL)THIO-4-ISOPROPYL-1-(PYRIDIN-4-YL-METHYL)-1H-IMIDAZOL-2-YL-METHYL CARBAMATEPDBeChem
Manual XrefsDatabases
S11PDBeChem