Vitas-M small molecule compound

(5Z)-5-{2-[2-(4-tert-butylphenoxy)ethoxy]-5-chlorobenzylidene}-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK099757
SMILES S=C1NC(=O)/C(=C/c2cc(Cl)ccc2OCCOc2ccc(cc2)C(C)(C)C)/S1

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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 C22H22ClNO3S2 MW 448.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClNO3S2/c1-22(2,3)15-4-7-17(8-5-15)26-10-11-27-18-9-6-16(23)12-14(18)13-19-20(25)24-21(28)29-19/h4-9,12-13H,10-11H2,1-3H3,(H,24,25,28)/b19-13-
InChIKey
PJQPYQZYHSUTGA-UYRXBGFRSA-N
Synonyms

(5Z)5((2(2(4TERTBUTYLPHENOXY)ETHOXY)5CHLOROPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(2(2(4TERTBUTYLPHENOXY)ETHOXY)5CHLOROBENZYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C=C3C(=O)NC(=S)S3
InChI=1SC22H22ClNO3S2c122(23)154717(8515)26101127189616(23)1214(18)131920(25)2421(28)2919h491213H1011H213H3(H242528)b1913
MFCD02109125
S=C1NC(=O)C(=Cc2cc(Cl)ccc2OCCOc2ccc(cc2)C(C)(C)C)S1
STK099757
ZINC000013896255
ZINC13896255

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Available files

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