Vitas-M small molecule compound

2-methoxy-6-{(E)-[3-(2-methoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-chlorobenzoate

Catalog ID
STL367893
SMILES COC(=O)CN1C(=O)S/C(=C/c2cccc(c2OC(=O)c2ccccc2Cl)OC)/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 C21H16ClNO7S MW 461.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClNO7S/c1-28-15-9-5-6-12(18(15)30-20(26)13-7-3-4-8-14(13)22)10-16-19(25)23(21(27)31-16)11-17(24)29-2/h3-10H,11H2,1-2H3/b16-10+
InChIKey
SGDDUGRWSNPWTK-MHWRWJLKSA-N
Synonyms

(2methoxy6((E)(3(2methoxy2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)phenyl)2chlorobenzoate
2methoxy6((E)(3(2methoxy2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)phenyl2chlorobenzoate
COC(=O)CN1C(=O)SC(=Cc2cccc(c2OC(=O)c2ccccc2Cl)OC)C1=O
COC1=CC=CC(=C1OC(=O)C2=CC=CC=C2Cl)C=C3C(=O)N(C(=O)S3)CC(=O)OC
InChI=1SC21H16ClNO7Sc1281595612(18(15)3020(26)13734814(13)22)101619(25)23(21(27)3116)1117(24)292h310H11H212H3b1610+
MFCD28951971
ZINC000098086386
ZINC98086386

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Available files

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