Vitas-M small molecule compound
(4E)-5-(3-ethoxyphenyl)-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
STK597186
SMILES CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C(=O)N1c1nnc(s1)C
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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 C25H23N3O5S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S/c1-4-32-18-7-5-6-15(12-18)21-20(23(30)24(31)28(21)25-27-26-14(3)34-25)22(29)16-8-9-19-17(11-16)10-13(2)33-19/h5-9,11-13,21,29H,4,10H2,1-3H3/b22-20+InChIKey
FARHLKOMKTXXOU-LSDHQDQOSA-NSynonyms
900285-65-6(4E)5(3ethoxyphenyl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)1(5methyl134thiadiazol2yl)pyrrolidine23dione
900285656
CCOC1=CC=CC(=C1)C2C(=C(C3=CC4=C(C=C3)OC(C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)C
CCOc1cccc(c1)C1C(=C(c2ccc3c(c2)CC(O3)C)O)C(=O)C(=O)N1c1nnc(s1)C
InChI=1SC25H23N3O5Sc14321875615(1218)2120(23(30)24(31)28(21)25272614(3)3425)22(29)16891917(1116)1013(2)3319h5911132129H410H213H3b2220+
MFCD07199071
ZINC000102622748
ZINC000102679740
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