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-(propan-2-yl)phenyl]ethanamide

Catalog ID
STK567319
SMILES CCOc1ccc(cc1/C=c\1/s/c(=C(/C(=O)Nc2ccc(cc2)C(C)C)\C#N)/n(c1=O)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 C30H26BrN3O3S MW 588.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26BrN3O3S/c1-4-37-26-15-12-22(31)16-21(26)17-27-29(36)34(24-8-6-5-7-9-24)30(38-27)25(18-32)28(35)33-23-13-10-20(11-14-23)19(2)3/h5-17,19H,4H2,1-3H3,(H,33,35)/b27-17+,30-25+
InChIKey
IHFHESGUSUGIHV-FYIQHRETSA-N
Synonyms

(2E)2((5E)5((5BROMO2ETHOXYPHENYL)METHYLIDENE)4OXO3PHENYL13THIAZOLIDIN2YLIDENE)2CYANON(4PROPAN2YLPHENYL)ACETAMIDE
(2E)2((5E)5(5bromo2ethoxybenzylidene)4oxo3phenyl13thiazolidin2ylidene)2cyanoN(4(propan2yl)phenyl)ethanamide
(E)2((E)5(5bromo2ethoxybenzylidene)4oxo3phenylthiazolidin2ylidene)2cyanoN(4isopropylphenyl)acetamide
CCOC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=C(C#N)C(=O)NC3=CC=C(C=C3)C(C)C)S2)C4=CC=CC=C4
CCOc1ccc(cc1C=c1sc(=C(C(=O)Nc2ccc(cc2)C(C)C)C#N)n(c1=O)c1ccccc1)Br
InChI=1SC30H26BrN3O3Sc143726151222(31)1621(26)172729(36)34(248657924)30(3827)25(1832)28(35)3323131020(111423)19(2)3h51719H4H213H3(H3335)b2717+3025+
MFCD05732851
ZINC000097967281
ZINC97967281

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Available files

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