CHEBI:107182 - 8-bromo-6-ethyl-N-(2-oxolanylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide

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ChEBI Name 8-bromo-6-ethyl-N-(2-oxolanylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide ChEBI ID CHEBI:107182 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C21H21BrN2O2S Net Charge 0 Average Mass 445.374 Monoisotopic Mass 444.05071 InChI InChI=1S/C21H21BrN2O2S/c1-2-17-16-11-14(22)6-8-19(16)27-20-7-5-13(10-18(20)24-17)21(25)23-12-15-4-3-9-26-15/h5-8,10-11,15H,2-4,9,12H2,1H3,(H,23,25) InChIKey FWDGNGNJNVPPMH-UHFFFAOYSA-N SMILES CCC1=NC2=C(C=CC(=C2)C(=O)NCC3CCCO3)SC4=C1C=C(C=C4)Br ChEBI Ontology Outgoing 8-bromo-6-ethyl-N-(2-oxolanylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide (CHEBI:107182) is a dibenzothiazepine (CHEBI:39268) Manual Xref Database LSM-18536 LINCS View more database links