Vitas-M small molecule compound
ethyl (2Z)-[3-(4-bromophenyl)-5-(4-fluorobenzyl)-4-oxo-1,3-thiazolidin-2-ylidene](cyano)ethanoate
Catalog ID
STL022156
SMILES CCOC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)Br)Cc1ccc(cc1)F)/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 C21H16BrFN2O3S MW 475.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrFN2O3S/c1-2-28-21(27)17(12-24)20-25(16-9-5-14(22)6-10-16)19(26)18(29-20)11-13-3-7-15(23)8-4-13/h3-10,18H,2,11H2,1H3/b20-17-InChIKey
QNLCERLHROCBNL-JZJYNLBNSA-NSynonyms
786679-79-6786679796
CCOC(=O)C(=C1N(C(=O)C(S1)CC2=CC=C(C=C2)F)C3=CC=C(C=C3)Br)C#N
CCOC(=O)C(=C1SC(C(=O)N1c1ccc(cc1)Br)Cc1ccc(cc1)F)C#N
ethyl(2Z)(3(4bromophenyl)5(4fluorobenzyl)4oxo13thiazolidin2ylidene)(cyano)ethanoate
ethyl(2Z)2(3(4bromophenyl)5((4fluorophenyl)methyl)4oxo13thiazolidin2ylidene)2cyanoacetate
ETHYL2(3(4BROMOPHENYL)5((4FLUOROPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANOACETATE
InChI=1SC21H16BrFN2O3Sc122821(27)17(1224)2025(169514(22)61016)19(26)18(2920)11133715(23)8413h31018H211H21H3b2017
MFCD06640921
ZINC000008717775
ZINC000008717776
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