Vitas-M small molecule compound

2-methoxy-4-[(E)-(4-oxo-3-phenyl-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-methylbenzoate

Catalog ID
STK069493
SMILES COc1cc(ccc1OC(=O)c1cccc(c1)C)/C=C\1/SC(=S)N(C1=O)c1ccccc1

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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 C25H19NO4S2 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO4S2/c1-16-7-6-8-18(13-16)24(28)30-20-12-11-17(14-21(20)29-2)15-22-23(27)26(25(31)32-22)19-9-4-3-5-10-19/h3-15H,1-2H3/b22-15+
InChIKey
VAYWWTCEQJPWNX-PXLXIMEGSA-N
Synonyms
5666-94-4
(2METHOXY4((E)(4OXO3PHENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3METHYLBENZOATE
2METHOXY4((4OXO3PHENYL2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL3METHYLBENZOATE
2METHOXY4((E)(4OXO3PHENYL2THIOXO13THIAZOLIDIN5YLIDENE)METHYL)PHENYL3METHYLBENZOATE
5666944
CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC=CC=C4)OC
COc1cc(ccc1OC(=O)c1cccc(c1)C)C=C1SC(=S)N(C1=O)c1ccccc1
InChI=1SC25H19NO4S2c11676818(1316)24(28)3020121117(1421(20)292)152223(27)26(25(31)3222)1994351019h315H12H3b2215+
MFCD00806236
STK069493
ZINC000002074834
ZINC02074834
ZINC2074834

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Available files

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