Vitas-M small molecule compound
ethyl 6-bromo-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4-[(dimethylamino)methyl]-5-hydroxy-1-methyl-1H-indole-3-carboxylate
Catalog ID
STK683893
SMILES CCOC(=O)c1c2c(CN(C)C)c(O)c(cc2n(c1CSc1nc(C)cc(c1C#N)C)C)Br
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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 C24H27BrN4O3S MW 531.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27BrN4O3S/c1-7-32-24(31)21-19(12-33-23-15(10-26)13(2)8-14(3)27-23)29(6)18-9-17(25)22(30)16(20(18)21)11-28(4)5/h8-9,30H,7,11-12H2,1-6H3InChIKey
SJXQWSKJDSIIRC-UHFFFAOYSA-NSynonyms
754155-92-51METHYL2(((3CYANO46DIMETHYL2PYRIDYL)THIO)METHYL)4((DIMETHYLAMINO)METHYL)5HYDROXY6BROMO1HINDOLE3CARBOXYLICACIDETHYLESTER
754155925
CCOC(=O)C1=C(N(C2=CC(=C(C(=C21)CN(C)C)O)Br)C)CSC3=C(C(=CC(=N3)C)C)C#N
ETHYL6BROMO2(((3CYANO46DIMETHYL2PYRIDINYL)SULFANYL)METHYL)4((DIMETHYLAMINO)METHYL)5HYDROXY1METHYL1HINDOLE3CARBOXYLATE
ethyl6bromo2(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)4((dimethylamino)methyl)5hydroxy1methyl1Hindole3carboxylate
ethyl6bromo2((3cyano46dimethylpyridin2yl)sulfanylmethyl)4((dimethylamino)methyl)5hydroxy1methylindole3carboxylate
ETHYL6BROMO2((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4(DIMETHYLAMINOMETHYL)5HYDROXY1METHYLINDOLE3CARBOXYLATE
InChI=1SC24H27BrN4O3Sc173224(31)2119(12332315(1026)13(2)814(3)2723)29(6)18917(25)22(30)16(20(18)21)1128(4)5h8930H71112H216H3
MFCD05258983
ZINC000001423452
ZINC1423452
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