Vitas-M small molecule compound
(4E)-5-(3,4-dichlorophenyl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK581090
SMILES CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nnc(s1)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 C23H17Cl2N3O4S MW 502.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N3O4S/c1-10-7-14-8-13(4-6-17(14)32-10)20(29)18-19(12-3-5-15(24)16(25)9-12)28(22(31)21(18)30)23-27-26-11(2)33-23/h3-6,8-10,19,29H,7H2,1-2H3/b20-18+InChIKey
OKBVGDJVMRLNSO-CZIZESTLSA-NSynonyms
897835-54-0(4E)5(34dichlorophenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(5methyl134thiadiazol2yl)pyrrolidine23dione
897835540
CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)C)C5=CC(=C(C=C5)Cl)Cl)O
CC1Oc2c(C1)cc(cc2)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)c1nnc(s1)C)O
InChI=1SC23H17Cl2N3O4Sc110714813(4617(14)3210)20(29)1819(123515(24)16(25)912)28(22(31)21(18)30)23272611(2)3323h368101929H7H212H3b2018+
MFCD07197338
ZINC000102589811
ZINC000102665799
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