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CHEBI:759612 - jnj-64264681

Default Structure
ChEBI IDCHEBI:759612
ChEBI Namejnj-64264681
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC27H30N6O3S
Net Charge0
Average Mass518.643
Monoisotopic Mass518.21001
SMILESC=CC(=O)N[C@H]1CCC[C@H]1NC(=O)c1sc2nccc3c2c1NC(=O)N3c1cnc(CC(C)C)cc1C
InChIInChI=1S/C27H30N6O3S/c1-5-21(34)30-17-7-6-8-18(17)31-25(35)24-23-22-19(9-10-28-26(22)37-24)33(27(36)32-23)20-13-29-16(11-14(2)3)12-15(20)4/h5,9-10,12-14,17-18H,1,6-8,11H2,2-4H3,(H,30,34)(H,31,35)(H,32,36)/t17-,18+/m0/s1
InChIKeyOPLNLPWGEZNZFL-ZWKOTPCHSA-N
ChEBI Ontology
Outgoing Relation(s)
jnj-64264681 (CHEBI:759612) is a thienopyridine (CHEBI:37942)
Synonym  Source
Jnj-64264681ChEMBL