Vitas-M small molecule compound
ethyl (2Z)-[5-(3-chlorobenzyl)-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene](cyano)ethanoate
Catalog ID
STL022137
SMILES CCOC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)F)Cc1cccc(c1)Cl)/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 C21H16ClFN2O3S MW 430.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN2O3S/c1-2-28-21(27)17(12-24)20-25(16-8-6-15(23)7-9-16)19(26)18(29-20)11-13-4-3-5-14(22)10-13/h3-10,18H,2,11H2,1H3/b20-17-InChIKey
NOMBTALDTBFWEN-JZJYNLBNSA-NSynonyms
786677-99-4786677994
CCOC(=O)C(=C1N(C(=O)C(S1)CC2=CC(=CC=C2)Cl)C3=CC=C(C=C3)F)C#N
CCOC(=O)C(=C1SC(C(=O)N1c1ccc(cc1)F)Cc1cccc(c1)Cl)C#N
ethyl(2Z)(5(3chlorobenzyl)3(4fluorophenyl)4oxo13thiazolidin2ylidene)(cyano)ethanoate
ETHYL(2Z)2(5((3CHLOROPHENYL)METHYL)3(4FLUOROPHENYL)4OXO13THIAZOLIDIN2YLIDENE)2CYANOACETATE
ETHYL2(5((3CHLOROPHENYL)METHYL)3(4FLUOROPHENYL)4OXO(13THIAZOLIDIN2YLIDENE))2CYANOACETATE
InChI=1SC21H16ClFN2O3Sc122821(27)17(1224)2025(168615(23)7916)19(26)18(2920)111343514(22)1013h31018H211H21H3b2017
MFCD06640743
ZINC000001790223
ZINC000001790227
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