Vitas-M small molecule compound
(4E)-4-[(5-chloro-2-methoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Catalog ID
STK641979
SMILES COc1ccc(cc1/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nnc(s1)C)/O)Cl
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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 C21H16ClN3O4S MW 441.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O4S/c1-11-23-24-21(30-11)25-17(12-6-4-3-5-7-12)16(19(27)20(25)28)18(26)14-10-13(22)8-9-15(14)29-2/h3-10,17,26H,1-2H3/b18-16+InChIKey
DBFZKAIKBXCCGU-FBMGVBCBSA-NSynonyms
951950-00-8(4E)4((5chloro2methoxyphenyl)(hydroxy)methylidene)1(5methyl134thiadiazol2yl)5phenylpyrrolidine23dione
(4E)4((5chloro2methoxyphenyl)hydroxymethylidene)1(5methyl134thiadiazol2yl)5phenylpyrrolidine23dione
951950008
CC1=NN=C(S1)N2C(C(=C(C3=C(C=CC(=C3)Cl)OC)O)C(=O)C2=O)C4=CC=CC=C4
COc1ccc(cc1C(=C1C(=O)C(=O)N(C1c1ccccc1)c1nnc(s1)C)O)Cl
InChI=1SC21H16ClN3O4Sc111232421(3011)2517(126435712)16(19(27)20(25)28)18(26)141013(22)8915(14)292h3101726H12H3b1816+
MFCD18162817
ZINC000102748122
ZINC000102748125
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