Vitas-M small molecule compound
(4E)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-phenoxyphenyl)pyrrolidine-2,3-dione
Catalog ID
STL048995
SMILES COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1cccc(c1)Oc1ccccc1
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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 C34H26N2O6S MW 590.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26N2O6S/c1-19-15-22-16-21(11-14-27(22)41-19)31(37)29-30(20-7-6-10-25(17-20)42-23-8-4-3-5-9-23)36(33(39)32(29)38)34-35-26-13-12-24(40-2)18-28(26)43-34/h3-14,16-19,30,37H,15H2,1-2H3/b31-29+InChIKey
JZJGRYSKRWGPNW-OWWNRXNESA-NSynonyms
893697-72-8(4E)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(6methoxy13benzothiazol2yl)5(3phenoxyphenyl)pyrrolidine23dione
893697728
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NC5=C(S4)C=C(C=C5)OC)C6=CC(=CC=C6)OC7=CC=CC=C7)O
COc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)CC(O3)C)O)C1c1cccc(c1)Oc1ccccc1
InChI=1SC34H26N2O6Sc11915221621(111427(22)4119)31(37)2930(20761025(1720)42238435923)36(33(39)32(29)38)343526131224(402)1828(26)4334h31416193037H15H212H3b3129+
MFCD05725195
ZINC000102887061
ZINC000102887067
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