Vitas-M small molecule compound
2-bromo-6-methoxy-4-(3-methyl-5-oxo-4,5,7,8-tetrahydro-1H-furo[3,4-b]pyrazolo[4,3-e]pyridin-4-yl)phenyl acetate
Catalog ID
STK354566
SMILES COc1cc(cc(c1OC(=O)C)Br)C1C2=C(COC2=O)Nc2c1c(C)n[nH]2
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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 C18H16BrN3O5 MW 434.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3O5/c1-7-13-14(15-11(6-26-18(15)24)20-17(13)22-21-7)9-4-10(19)16(27-8(2)23)12(5-9)25-3/h4-5,14H,6H2,1-3H3,(H2,20,21,22)InChIKey
DZIKZPDICAHMPI-UHFFFAOYSA-NSynonyms
2bromo6methoxy4(3methyl5oxo4578tetrahydro1Hfuro(34b)pyrazolo(43e)pyridin4yl)phenylacetate
CC1=C2C(C3=C(COC3=O)N=C2NN1)C4=CC(=C(C(=C4)Br)OC(=O)C)OC
COc1cc(cc(c1OC(=O)C)Br)C1C2=C(COC2=O)Nc2c1c(C)n(nH)2
InChI=1SC18H16BrN3O5c171314(1511(62618(15)24)2017(13)22217)9410(19)16(278(2)23)12(59)253h4514H6H213H3(H2202122)
MFCD11851737
ZINC000020086581
ZINC000020086583
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