Vitas-M small molecule compound
4-[(5Z)-5-(4-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2,3-dimethylphenyl)butanamide
Catalog ID
STK994542
SMILES O=C(Nc1cccc(c1C)C)CCCN1C(=S)S/C(=C\c2ccc(cc2)Br)/C1=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 C22H21BrN2O2S2 MW 489.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21BrN2O2S2/c1-14-5-3-6-18(15(14)2)24-20(26)7-4-12-25-21(27)19(29-22(25)28)13-16-8-10-17(23)11-9-16/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,24,26)/b19-13-InChIKey
DWKPHGQMNJSIHW-UYRXBGFRSA-NSynonyms
4((5Z)5((4bromophenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)N(23dimethylphenyl)butanamide
4((5Z)5(4bromobenzylidene)4oxo2thioxo13thiazolidin3yl)N(23dimethylphenyl)butanamide
CC1=C(C(=CC=C1)NC(=O)CCCN2C(=O)C(=CC3=CC=C(C=C3)Br)SC2=S)C
InChI=1SC22H21BrN2O2S2c11453618(15(14)2)2420(26)74122521(27)19(2922(25)28)131681017(23)11916h35681113H4712H212H3(H2426)b1913
MFCD02655294
N(23DIMETHYLPHENYL)4(5((4BROMOPHENYL)METHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))BUTANAMIDE
O=C(Nc1cccc(c1C)C)CCCN1C(=S)SC(=Cc2ccc(cc2)Br)C1=O
ZINC000012276161
ZINC12276161
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