Vitas-M small molecule compound

(5Z)-5-{3-bromo-4-[2-(4-cyclohexylphenoxy)ethoxy]-5-methoxybenzylidene}-2-imino-1,3-thiazolidin-4-one

Catalog ID
STK542651
SMILES COc1cc(/C=C/2\SC(=N)NC2=O)cc(c1OCCOc1ccc(cc1)C1CCCCC1)Br

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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 C25H27BrN2O4S MW 531.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27BrN2O4S/c1-30-21-14-16(15-22-24(29)28-25(27)33-22)13-20(26)23(21)32-12-11-31-19-9-7-18(8-10-19)17-5-3-2-4-6-17/h7-10,13-15,17H,2-6,11-12H2,1H3,(H2,27,28,29)/b22-15-
InChIKey
FNRRHBFEUGBZQO-JCMHNJIXSA-N
Synonyms
497241-96-0
(5Z)2AMINO5((3BROMO4(2(4CYCLOHEXYLPHENOXY)ETHOXY)5METHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)5(3bromo4(2(4cyclohexylphenoxy)ethoxy)5methoxybenzylidene)2imino13thiazolidin4one
(Z)5(3bromo4(2(4cyclohexylphenoxy)ethoxy)5methoxybenzylidene)2iminothiazolidin4one
497241960
COC1=C(C(=CC(=C1)C=C2C(=O)N=C(S2)N)Br)OCCOC3=CC=C(C=C3)C4CCCCC4
COc1cc(C=C2SC(=N)NC2=O)cc(c1OCCOc1ccc(cc1)C1CCCCC1)Br
InChI=1SC25H27BrN2O4Sc130211416(152224(29)2825(27)3322)1320(26)23(21)32121131199718(81019)175324617h710131517H261112H21H3(H2272829)b2215
MFCD03300120
ZINC000100885476
ZINC100885476

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Available files

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