Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[2-(4-chloro-3-methylphenoxy)ethoxy]-5-ethoxybenzylidene}-3-methyl-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK065217
SMILES CCOc1cc(/C=C/2\SC(=S)N(C2=O)C)cc(c1OCCOc1ccc(c(c1)C)Cl)Cl
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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 C22H21Cl2NO4S2 MW 498.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21Cl2NO4S2/c1-4-27-18-11-14(12-19-21(26)25(3)22(30)31-19)10-17(24)20(18)29-8-7-28-15-5-6-16(23)13(2)9-15/h5-6,9-12H,4,7-8H2,1-3H3/b19-12-InChIKey
GTVVEQKONLQRCY-UNOMPAQXSA-NSynonyms
(5Z)5((3CHLORO4(2(4CHLORO3METHYLPHENOXY)ETHOXY)5ETHOXYPHENYL)METHYLIDENE)3METHYL2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(3CHLORO4(2(4CHLORO3METHYLPHENOXY)ETHOXY)5ETHOXYBENZYLIDENE)3METHYL2THIOXO13THIAZOLIDIN4ONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)C)Cl)OCCOC3=CC(=C(C=C3)Cl)C
CCOc1cc(C=C2SC(=S)N(C2=O)C)cc(c1OCCOc1ccc(c(c1)C)Cl)Cl
InChI=1SC22H21Cl2NO4S2c1427181114(121921(26)25(3)22(30)3119)1017(24)20(18)298728155616(23)13(2)915h56912H478H213H3b1912
MFCD02922780
STK065217
ZINC000013897646
ZINC13897646
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