Vitas-M small molecule compound
{(5E)-5-[1-(2,6-dichlorobenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid
Catalog ID
STK336295
SMILES OC(=O)CN1C(=S)S/C(=C/2\c3ccccc3N(C2=O)Cc2c(Cl)cccc2Cl)/C1=O
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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 C20H12Cl2N2O4S2 MW 479.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12Cl2N2O4S2/c21-12-5-3-6-13(22)11(12)8-23-14-7-2-1-4-10(14)16(18(23)27)17-19(28)24(9-15(25)26)20(29)30-17/h1-7H,8-9H2,(H,25,26)/b17-16+InChIKey
WAOLXANKWPHENJ-WUKNDPDISA-NSynonyms
((5E)5(1(26DICHLOROBENZYL)2OXO12DIHYDRO3HINDOL3YLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)ACETICACID
2((5E)5(1((26dichlorophenyl)methyl)2oxoindol3ylidene)4oxo2sulfanylidene13thiazolidin3yl)aceticacid
C1=CC=C2C(=C1)C(=C3C(=O)N(C(=S)S3)CC(=O)O)C(=O)N2CC4=C(C=CC=C4Cl)Cl
InChI=1SC20H12Cl2N2O4S2c211253613(22)11(12)82314721410(14)16(18(23)27)1719(28)24(915(25)26)20(29)3017h17H89H2(H2526)b1716+
MFCD05815949
OC(=O)CN1C(=S)SC(=C2c3ccccc3N(C2=O)Cc2c(Cl)cccc2Cl)C1=O
ZINC000009234592
ZINC9234592
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