Vitas-M small molecule compound
(2E)-2-[(5E)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-N-(3-chlorophenyl)-2-cyanoethanamide
Catalog ID
STK549757
SMILES COc1cc(cc(c1O)Br)/C=c\1/s/c(=C(/C(=O)Nc2cccc(c2)Cl)\C#N)/n(c1=O)c1ccccc1
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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 C26H17BrClN3O4S MW 582.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17BrClN3O4S/c1-35-21-11-15(10-20(27)23(21)32)12-22-25(34)31(18-8-3-2-4-9-18)26(36-22)19(14-29)24(33)30-17-7-5-6-16(28)13-17/h2-13,32H,1H3,(H,30,33)/b22-12+,26-19+InChIKey
ILZDOHWYENDKFD-YZFIOTTDSA-NSynonyms
(2E)2((5E)5((3BROMO4HYDROXY5METHOXYPHENYL)METHYLIDENE)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)N(3CHLOROPHENYL)2CYANOACETAMIDE
(2E)2((5E)5(3bromo4hydroxy5methoxybenzylidene)4oxo3phenyl13thiazolidin2ylidene)N(3chlorophenyl)2cyanoethanamide
(E)2((E)5(3bromo4hydroxy5methoxybenzylidene)4oxo3phenylthiazolidin2ylidene)N(3chlorophenyl)2cyanoacetamide
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=C(C#N)C(=O)NC3=CC(=CC=C3)Cl)S2)C4=CC=CC=C4)Br)O
COc1cc(cc(c1O)Br)C=c1sc(=C(C(=O)Nc2cccc(c2)Cl)C#N)n(c1=O)c1ccccc1
InChI=1SC26H17BrClN3O4Sc135211115(1020(27)23(21)32)122225(34)31(188324918)26(3622)19(1429)24(33)301775616(28)1317h21332H1H3(H3033)b2212+2619+
MFCD03680473
ZINC000097966680
ZINC97966680
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