Vitas-M small molecule compound
4-(5-bromo-2-fluorophenyl)-2,6-dihydro-4H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STK636005
SMILES OC1=Nc2n[nH]cc2C(SC1)c1cc(Br)ccc1F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H9BrFN3OS MW 342.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9BrFN3OS/c13-6-1-2-9(14)7(3-6)11-8-4-15-17-12(8)16-10(18)5-19-11/h1-4,11H,5H2,(H2,15,16,17,18)InChIKey
JPUIGYLIJLLOOJ-UHFFFAOYSA-NSynonyms
1171941-75-51171941755
4(5bromo2fluorophenyl)24dihydro1Hpyrazolo(34e)(14)thiazepin7one
4(5bromo2fluorophenyl)26dihydro4Hpyrazolo(34e)(14)thiazepin7ol
C1C(=O)N=C2C(=CNN2)C(S1)C3=C(C=CC(=C3)Br)F
InChI=1SC12H9BrFN3OSc136129(14)7(36)1184151712(8)1610(18)51911h1411H5H2(H215161718)
MFCD18160927
OC1=Nc2n(nH)cc2C(SC1)c1cc(Br)ccc1F
ZINC000020717355
ZINC000020717358
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