Vitas-M small molecule compound
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(4-hydroxy-3-methoxyphenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL057379
SMILES COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)CC(O2)C)/O
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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 C28H21ClN2O6S MW 549.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClN2O6S/c1-13-9-16-10-15(4-8-20(16)37-13)25(33)23-24(14-3-7-19(32)21(11-14)36-2)31(27(35)26(23)34)28-30-18-6-5-17(29)12-22(18)38-28/h3-8,10-13,24,32-33H,9H2,1-2H3/b25-23+InChIKey
HUHSWABZFOOHEP-WJTDDFOZSA-NSynonyms
850190-74-8(4E)1(6chloro13benzothiazol2yl)5(4hydroxy3methoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
850190748
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)Cl)C6=CC(=C(C=C6)O)OC)O
COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)C(=O)C1=C(c1ccc2c(c1)CC(O2)C)O
InChI=1SC28H21ClN2O6Sc1139161015(4820(16)3713)25(33)2324(143719(32)21(1114)362)31(27(35)26(23)34)2830186517(29)1222(18)3828h381013243233H9H212H3b2523+
MFCD05738604
ZINC000102897423
ZINC000102897430
Check stock
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