CHEBI:117125 - N-[3-(1-azepanyl)propyl]-2-(4-morpholinyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide

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ChEBI Name N-[3-(1-azepanyl)propyl]-2-(4-morpholinyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide
ChEBI ID CHEBI:117125
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H32N4O3S
Net Charge 0
Average Mass 432.581
Monoisotopic Mass 432.21951
InChI InChI=1S/C22H32N4O3S/c27-20(23-8-5-11-25-9-3-1-2-4-10-25)17-6-7-19-18(16-17)24-21(28)22(30-19)26-12-14-29-15-13-26/h6-7,16,22H,1-5,8-15H2,(H,23,27)(H,24,28)
InChIKey DNEQSWPVLQJHOO-UHFFFAOYSA-N
SMILES C1CCCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)SC(C(=O)N3)N4CCOCC4
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via benzothiazine )
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ChEBI Ontology
Outgoing N-[3-(1-azepanyl)propyl]-2-(4-morpholinyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide (CHEBI:117125) is a benzothiazine (CHEBI:46899)
Manual Xref Database
LSM-28574 LINCS
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