Vitas-M small molecule compound
tert-butyl 2-{[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Catalog ID
STK200277
SMILES CN1CCc2c(C1)sc(c2C(=O)OC(C)(C)C)/N=C/c1cc(Br)cc(c1O)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 C20H22Br2N2O3S MW 530.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22Br2N2O3S/c1-20(2,3)27-19(26)16-13-5-6-24(4)10-15(13)28-18(16)23-9-11-7-12(21)8-14(22)17(11)25/h7-9,25H,5-6,10H2,1-4H3/b23-9+InChIKey
ZUKRFAFOYSCTIR-NUGSKGIGSA-NSynonyms
362481-23-0(Z)tertbutyl2((35dibromo2hydroxybenzylidene)amino)6methyl4567tetrahydrothieno(23c)pyridine3carboxylate
24dibromo6((E)(6methyl3((2methylpropan2yl)oxycarbonyl)4567tetrahydrothieno(23c)pyridin6ium2yl)iminomethyl)phenolate
362481230
CC(C)(C)OC(=O)C1=C(SC2=C1CC(NH+)(C2)C)N=CC3=CC(=CC(=C3(O))Br)Br
CN1CCc2c(C1)sc(c2C(=O)OC(C)(C)C)N=Cc1cc(Br)cc(c1O)Br
InChI=1SC20H22Br2N2O3Sc120(23)2719(26)16135624(4)1015(13)2818(16)23911712(21)814(22)17(11)25h7925H5610H214H3b239+
MFCD01147666
tertbutyl2(((E)(35dibromo2hydroxyphenyl)methylidene)amino)6methyl4567tetrahydrothieno(23c)pyridine3carboxylate
ZINC000001250323
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