Vitas-M small molecule compound
4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate
Catalog ID
STK821729
SMILES COc1cc(ccc1OC(=O)C1C(C1(C)C)C=C(Cl)Cl)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C26H23Cl2NO4S2 MW 548.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2NO4S2/c1-26(2)17(13-21(27)28)22(26)24(31)33-18-10-9-16(11-19(18)32-3)12-20-23(30)29(25(34)35-20)14-15-7-5-4-6-8-15/h4-13,17,22H,14H2,1-3H3/b20-12-InChIKey
IFNKQOGYAPHXEY-NDENLUEZSA-NSynonyms
(4((Z)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2methoxyphenyl)3(22dichloroethenyl)22dimethylcyclopropane1carboxylate
4((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenyl3(22dichloroethenyl)22dimethylcyclopropanecarboxylate
CC1(C(C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)OC)C=C(Cl)Cl)C
COc1cc(ccc1OC(=O)C1C(C1(C)C)C=C(Cl)Cl)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC26H23Cl2NO4S2c126(2)17(1321(27)28)22(26)24(31)331810916(1119(18)323)122023(30)29(25(34)3520)14157546815h4131722H14H213H3b2012
MFCD01458118
ZINC000097946961
ZINC000097946964
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