Vitas-M small molecule compound

methyl (2-chloro-6-ethoxy-4-{(E)-[3-(naphthalen-2-ylmethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate

Catalog ID
STK318013
SMILES CCOc1cc(/C=C\2/SC(=O)N(C2=O)Cc2ccc3c(c2)cccc3)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 C26H22ClNO6S MW 511.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClNO6S/c1-3-33-21-12-17(11-20(27)24(21)34-15-23(29)32-2)13-22-25(30)28(26(31)35-22)14-16-8-9-18-6-4-5-7-19(18)10-16/h4-13H,3,14-15H2,1-2H3/b22-13+
InChIKey
WBOBXPCTZXNWOX-LPYMAVHISA-N
Synonyms

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=O)S2)CC3=CC4=CC=CC=C4C=C3)Cl)OCC(=O)OC
CCOc1cc(C=C2SC(=O)N(C2=O)Cc2ccc3c(c2)cccc3)cc(c1OCC(=O)OC)Cl
InChI=1SC26H22ClNO6Sc1333211217(1120(27)24(21)341523(29)322)132225(30)28(26(31)3522)14168918645719(18)1016h413H31415H212H3b2213+
methyl(2chloro6ethoxy4((E)(3(naphthalen2ylmethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)acetate
methyl2(2chloro6ethoxy4((E)(3(naphthalen2ylmethyl)24dioxo13thiazolidin5ylidene)methyl)phenoxy)acetate
MFCD09961415
ZINC000012650331
ZINC12650331

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Available files

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