Vitas-M small molecule compound

methyl {2-chloro-6-ethoxy-4-[(E)-{4-oxo-3-[(phenylcarbonyl)amino]-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}acetate

Catalog ID
STK281895
SMILES CCOc1cc(/C=C\2/SC(=S)N(C2=O)NC(=O)c2ccccc2)cc(c1OCC(=O)OC)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 C22H19ClN2O6S2 MW 506.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O6S2/c1-3-30-16-10-13(9-15(23)19(16)31-12-18(26)29-2)11-17-21(28)25(22(32)33-17)24-20(27)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3,(H,24,27)/b17-11+
InChIKey
SINYDXWFTBZZBY-GZTJUZNOSA-N
Synonyms

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3)Cl)OCC(=O)OC
CCOc1cc(C=C2SC(=S)N(C2=O)NC(=O)c2ccccc2)cc(c1OCC(=O)OC)Cl
InChI=1SC22H19ClN2O6S2c1330161013(915(23)19(16)311218(26)292)111721(28)25(22(32)3317)2420(27)147546814h411H312H212H3(H2427)b1711+
METHYL(2CHLORO6ETHOXY4((E)(4OXO3((PHENYLCARBONYL)AMINO)2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
methyl2(4((E)(3benzamido4oxo2sulfanylidene13thiazolidin5ylidene)methyl)2chloro6ethoxyphenoxy)acetate
MFCD04084304
ZINC000009187019
ZINC09187019
ZINC9187019

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Available files

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