Vitas-M small molecule compound
methyl [6-amino-4-(3-bromo-4-methoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-3-yl]acetate
Catalog ID
STK693749
SMILES COC(=O)Cc1n[nH]c2c1C(c1ccc(c(c1)Br)OC)C(=C(O2)N)C#N
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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 C17H15BrN4O4 MW 419.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O4/c1-24-12-4-3-8(5-10(12)18)14-9(7-19)16(20)26-17-15(14)11(21-22-17)6-13(23)25-2/h3-5,14H,6,20H2,1-2H3,(H,21,22)InChIKey
UDQBHTOKHQMKHU-UHFFFAOYSA-NSynonyms
COC(=O)Cc1n(nH)c2c1C(c1ccc(c(c1)Br)OC)C(=C(O2)N)C#N
COC1=C(C=C(C=C1)C2C(=C(OC3=NNC(=C23)CC(=O)OC)N)C#N)Br
InChI=1SC17H15BrN4O4c12412438(510(12)18)149(719)16(20)261715(14)11(212217)613(23)252h3514H620H212H3(H2122)
methyl(6amino4(3bromo4methoxyphenyl)5cyano14dihydropyrano(23c)pyrazol3yl)acetate
methyl2(6amino4(3bromo4methoxyphenyl)5cyano24dihydropyrano(23c)pyrazol3yl)acetate
MFCD12033834
ZINC000015108117
ZINC000015108120
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