EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:754652 - pretamazium

Default Structure
ChEBI IDCHEBI:754652
ChEBI Namepretamazium
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H29N2S
Net Charge+1
Average Mass437.632
Monoisotopic Mass437.20460
SMILESCC[n+]1c(-c2ccc(-c3ccccc3)cc2)csc1/C=C/c1ccc(N2CCCC2)cc1
InChIInChI=1S/C29H29N2S/c1-2-31-28(26-15-13-25(14-16-26)24-8-4-3-5-9-24)22-32-29(31)19-12-23-10-17-27(18-11-23)30-20-6-7-21-30/h3-5,8-19,22H,2,6-7,20-21H2,1H3/q+1
InChIKeyNNVAJWZEDBJMFG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
pretamazium (CHEBI:754652) is a pyrrolidines (CHEBI:38260)