Vitas-M small molecule compound
ethyl 2-({(E)-[3-(3-methoxypropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}amino)benzoate
Catalog ID
STK991790
SMILES COCCCN1C(=S)S/C(=C/Nc2ccccc2C(=O)OCC)/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 C17H20N2O4S2 MW 380.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S2/c1-3-23-16(21)12-7-4-5-8-13(12)18-11-14-15(20)19(17(24)25-14)9-6-10-22-2/h4-5,7-8,11,18H,3,6,9-10H2,1-2H3/b14-11+InChIKey
BZCRPCDJWSOXSJ-SDNWHVSQSA-NSynonyms
(E)ethyl2(((3(3methoxypropyl)4oxo2thioxothiazolidin5ylidene)methyl)amino)benzoate
CCOC(=O)C1=CC=CC=C1NC=C2C(=O)N(C(=S)S2)CCCOC
COCCCN1C(=S)SC(=CNc2ccccc2C(=O)OCC)C1=O
ethyl2(((E)(3(3methoxypropyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)amino)benzoate
ethyl2(((E)(3(3methoxypropyl)4oxo2thioxo13thiazolidin5ylidene)methyl)amino)benzoate
InChI=1SC17H20N2O4S2c132316(21)12745813(12)18111415(20)19(17(24)2514)9610222h45781118H36910H212H3b1411+
MFCD09845218
ZINC000101472369
ZINC09422435
ZINC101472369
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