EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:115568 - 1-(2,6-dimethylphenyl)-3-[[1-(4-methoxyphenyl)-3-pyrrolidinyl]methyl]thiourea

ChEBI IDCHEBI:115568
ChEBI Name1-(2,6-dimethylphenyl)-3-[[1-(4-methoxyphenyl)-3-pyrrolidinyl]methyl]thiourea
Stars
DownloadsMolfile
FormulaC21H27N3OS
Net Charge0
Average Mass369.534
Monoisotopic Mass369.18748
SMILESCOc1ccc(N2CCC(CNC(=S)Nc3c(C)cccc3C)C2)cc1
InChIInChI=1S/C21H27N3OS/c1-15-5-4-6-16(2)20(15)23-21(26)22-13-17-11-12-24(14-17)18-7-9-19(25-3)10-8-18/h4-10,17H,11-14H2,1-3H3,(H2,22,23,26)
InChIKeyANXQJSVQYXQAAT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(2,6-dimethylphenyl)-3-[[1-(4-methoxyphenyl)-3-pyrrolidinyl]methyl]thiourea (CHEBI:115568) is a pyrrolidines (CHEBI:38260)
Manual XrefsDatabases
LSM-27025LINCS