Vitas-M small molecule compound
(4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(naphthalen-1-yl)pyrrolidine-2,3-dione
Catalog ID
STK618472
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc2c1cccc2)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 C26H21N3O4S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S/c1-3-33-18-13-11-17(12-14-18)23(30)21-22(20-10-6-8-16-7-4-5-9-19(16)20)29(25(32)24(21)31)26-28-27-15(2)34-26/h4-14,22,30H,3H2,1-2H3/b23-21+InChIKey
OOWJSWFGRCGYPA-XTQSDGFTSA-NSynonyms
371201-14-8(4E)4((4ethoxyphenyl)(hydroxy)methylidene)1(5methyl134thiadiazol2yl)5(naphthalen1yl)pyrrolidine23dione
(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(5METHYL134THIADIAZOL2YL)5NAPHTHALEN1YLPYRROLIDINE23DIONE
371201148
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NN=C(S3)C)C4=CC=CC5=CC=CC=C54)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc2c1cccc2)c1nnc(s1)C)O
InChI=1SC26H21N3O4Sc133318131117(121418)23(30)2122(20106816745919(16)20)29(25(32)24(21)31)26282715(2)3426h4142230H3H212H3b2321+
MFCD09797840
ZINC000102717335
ZINC000102717337
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