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CHEBI:121774 - 1-cyclopropyl-3-[6-oxo-5-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinyl]urea

ChEBI IDCHEBI:121774
ChEBI Name1-cyclopropyl-3-[6-oxo-5-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinyl]urea
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DownloadsMolfile
FormulaC24H21N3O2S
Net Charge0
Average Mass415.518
Monoisotopic Mass415.13545
SMILESO=C(Nc1ccc2c(c1)N(Cc1ccccc1)C(=O)c1ccccc1S2)NC1CC1
InChIInChI=1S/C24H21N3O2S/c28-23-19-8-4-5-9-21(19)30-22-13-12-18(26-24(29)25-17-10-11-17)14-20(22)27(23)15-16-6-2-1-3-7-16/h1-9,12-14,17H,10-11,15H2,(H2,25,26,29)
InChIKeyKHNSTLWEHCTSHA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-cyclopropyl-3-[6-oxo-5-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinyl]urea (CHEBI:121774) is a dibenzothiazepine (CHEBI:39268)
Manual XrefsDatabases
LSM-33217LINCS