Vitas-M small molecule compound
5-amino-7-(3-bromo-4-hydroxy-5-methoxyphenyl)-4-(4-fluorophenyl)-2,3,4,7-tetrahydrothieno[3,2-b]pyridine-6-carbonitrile 1,1-dioxide
Catalog ID
STK685402
SMILES N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C1c1cc(Br)c(c(c1)OC)O)S(=O)(=O)CC2
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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 C21H17BrFN3O4S MW 506.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrFN3O4S/c1-30-17-9-11(8-15(22)19(17)27)18-14(10-24)21(25)26(13-4-2-12(23)3-5-13)16-6-7-31(28,29)20(16)18/h2-5,8-9,18,27H,6-7,25H2,1H3InChIKey
GGFUKEWFCDHTJP-UHFFFAOYSA-NSynonyms
5AMINO7(3BROMO4HYDROXY5METHOXYPHENYL)4(4FLUOROPHENYL)11DIOXO37DIHYDRO2HTHIENO(32B)PYRIDINE6CARBONITRILE
5amino7(3bromo4hydroxy5methoxyphenyl)4(4fluorophenyl)2347tetrahydrothieno(32b)pyridine6carbonitrile11dioxide
COC1=C(C(=CC(=C1)C2C(=C(N(C3=C2S(=O)(=O)CC3)C4=CC=C(C=C4)F)N)C#N)Br)O
InChI=1SC21H17BrFN3O4Sc13017911(815(22)19(17)27)1814(1024)21(25)26(134212(23)3513)166731(2829)20(16)18h25891827H6725H21H3
MFCD05858741
ZINC000001429898
ZINC000001429899
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