Vitas-M small molecule compound

(4E)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-5-(3-hydroxyphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione

Catalog ID
STK578491
SMILES Oc1cccc(c1)C1/C(=C(/c2ccc(cc2)OCc2cccc(c2)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 C28H23N3O5S MW 513.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O5S/c1-16-5-3-6-18(13-16)15-36-22-11-9-19(10-12-22)25(33)23-24(20-7-4-8-21(32)14-20)31(27(35)26(23)34)28-30-29-17(2)37-28/h3-14,24,32-33H,15H2,1-2H3/b25-23+
InChIKey
SZFWHPDKXNZWNQ-WJTDDFOZSA-N
Synonyms
840456-36-2
(4E)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)5(3hydroxyphenyl)1(5methyl134thiadiazol2yl)pyrrolidine23dione
(4E)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)5(3HYDROXYPHENYL)1(5METHYL134THIADIAZOL2YL)PYRROLIDINE23DIONE
840456362
CC1=CC(=CC=C1)COC2=CC=C(C=C2)C(=C3C(N(C(=O)C3=O)C4=NN=C(S4)C)C5=CC(=CC=C5)O)O
InChI=1SC28H23N3O5Sc11653618(1316)15362211919(101222)25(33)2324(2074821(32)1420)31(27(35)26(23)34)28302917(2)3728h314243233H15H212H3b2523+
MFCD07205328
Oc1cccc(c1)C1C(=C(c2ccc(cc2)OCc2cccc(c2)C)O)C(=O)C(=O)N1c1nnc(s1)C
ZINC000102584107
ZINC000102584119

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Available files

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