Vitas-M small molecule compound
ethyl (2Z)-[3-(4-bromophenyl)-5-(2-chlorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene](cyano)ethanoate
Catalog ID
STL022151
SMILES CCOC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)Br)Cc1ccccc1Cl)/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 C21H16BrClN2O3S MW 491.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrClN2O3S/c1-2-28-21(27)16(12-24)20-25(15-9-7-14(22)8-10-15)19(26)18(29-20)11-13-5-3-4-6-17(13)23/h3-10,18H,2,11H2,1H3/b20-16-InChIKey
GDIQDTMPRZILET-SILNSSARSA-NSynonyms
CCOC(=O)C(=C1N(C(=O)C(S1)CC2=CC=CC=C2Cl)C3=CC=C(C=C3)Br)C#N
CCOC(=O)C(=C1SC(C(=O)N1c1ccc(cc1)Br)Cc1ccccc1Cl)C#N
ethyl(2Z)(3(4bromophenyl)5(2chlorobenzyl)4oxo13thiazolidin2ylidene)(cyano)ethanoate
ethyl(2Z)2(3(4bromophenyl)5((2chlorophenyl)methyl)4oxo13thiazolidin2ylidene)2cyanoacetate
ETHYL2(3(4BROMOPHENYL)5((2CHLOROPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANOACETATE
InChI=1SC21H16BrClN2O3Sc122821(27)16(1224)2025(159714(22)81015)19(26)18(2920)1113534617(13)23h31018H211H21H3b2016
MFCD06640913
ZINC000008717772
ZINC000009909988
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