Vitas-M small molecule compound
(2E)-2-[(5E)-5-(5-bromo-2-ethoxybenzylidene)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-2-cyano-N-(4-ethoxyphenyl)ethanamide
Catalog ID
STL042193
SMILES CCOc1ccc(cc1)NC(=O)/C(=c\1/s/c(=C/c2cc(Br)ccc2OCC)/c(=O)n1c1ccccc1)/C#N
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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 C29H24BrN3O4S MW 590.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24BrN3O4S/c1-3-36-23-13-11-21(12-14-23)32-27(34)24(18-31)29-33(22-8-6-5-7-9-22)28(35)26(38-29)17-19-16-20(30)10-15-25(19)37-4-2/h5-17H,3-4H2,1-2H3,(H,32,34)/b26-17+,29-24+InChIKey
WOQDSNFGTLVBBP-WIVSVQHBSA-NSynonyms
(2E)2((5E)5((5BROMO2ETHOXYPHENYL)METHYLIDENE)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)2CYANON(4ETHOXYPHENYL)ACETAMIDE
(2E)2((5E)5(5bromo2ethoxybenzylidene)4oxo3phenyl13thiazolidin2ylidene)2cyanoN(4ethoxyphenyl)ethanamide
(E)2((E)5(5bromo2ethoxybenzylidene)4oxo3phenylthiazolidin2ylidene)2cyanoN(4ethoxyphenyl)acetamide
CCOC1=CC=C(C=C1)NC(=O)C(=C2N(C(=O)C(=CC3=C(C=CC(=C3)Br)OCC)S2)C4=CC=CC=C4)C#N
CCOc1ccc(cc1)NC(=O)C(=c1sc(=Cc2cc(Br)ccc2OCC)c(=O)n1c1ccccc1)C#N
InChI=1SC29H24BrN3O4Sc133623131121(121423)3227(34)24(1831)2933(228657922)28(35)26(3829)17191620(30)101525(19)3742h517H34H212H3(H3234)b2617+2924+
MFCD05738004
ZINC000097969311
ZINC97969311
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