Vitas-M small molecule compound

(2Z,5Z)-5-[3-bromo-4-(prop-2-en-1-yloxy)benzylidene]-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

Catalog ID
STK159696
SMILES C=CCOc1ccc(cc1Br)/C=C/1\S/C(=N\c2cc(C)cc(c2)C)/NC1=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 C21H19BrN2O2S MW 443.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O2S/c1-4-7-26-18-6-5-15(11-17(18)22)12-19-20(25)24-21(27-19)23-16-9-13(2)8-14(3)10-16/h4-6,8-12H,1,7H2,2-3H3,(H,23,24,25)/b19-12-
InChIKey
HTWDKOKPNSLZLS-UNOMPAQXSA-N
Synonyms

(2Z5Z)5(3BROMO4(PROP2EN1YLOXY)BENZYLIDENE)2((35DIMETHYLPHENYL)IMINO)13THIAZOLIDIN4ONE
(5Z)5((3bromo4prop2enoxyphenyl)methylidene)2(35dimethylanilino)13thiazol4one
C=CCOc1ccc(cc1Br)C=C1SC(=Nc2cc(C)cc(c2)C)NC1=O
CC1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC(=C(C=C3)OCC=C)Br)S2)C
InChI=1SC21H19BrN2O2Sc14726186515(1117(18)22)121920(25)2421(2719)2316913(2)814(3)1016h46812H17H223H3(H232425)b1912
MFCD01610642
ZINC000009311193
ZINC09311193
ZINC9311193

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Available files

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