Vitas-M small molecule compound
(5Z)-5-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-iodo-5-methoxybenzylidene}-3-phenyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK084316
SMILES COc1cc(/C=C/2\SC(=S)N(C2=O)c2ccccc2)cc(c1OCCOc1ccc(cc1)C(C)(C)C)I
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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 C29H28INO4S2 MW 645.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28INO4S2/c1-29(2,3)20-10-12-22(13-11-20)34-14-15-35-26-23(30)16-19(17-24(26)33-4)18-25-27(32)31(28(36)37-25)21-8-6-5-7-9-21/h5-13,16-18H,14-15H2,1-4H3/b25-18-InChIKey
TXYKMIWHYPJDNE-BWAHOGKJSA-NSynonyms
(5Z)5((4(2(4TERTBUTYLPHENOXY)ETHOXY)3IODO5METHOXYPHENYL)METHYLIDENE)3PHENYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(4(2(4TERTBUTYLPHENOXY)ETHOXY)3IODO5METHOXYBENZYLIDENE)3PHENYL2THIOXO13THIAZOLIDIN4ONE
CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2I)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4)OC
COc1cc(C=C2SC(=S)N(C2=O)c2ccccc2)cc(c1OCCOc1ccc(cc1)C(C)(C)C)I
InChI=1SC29H28INO4S2c129(23)20101222(131120)341415352623(30)1619(1724(26)334)182527(32)31(28(36)3725)218657921h5131618H1415H214H3b2518
MFCD02109353
STK084316
ZINC000150442189
ZINC150442189
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