Vitas-M small molecule compound

(5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-({4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK719301
SMILES COc1cc(CCN2C(=S)S/C(=C\N3CCN(CC3)CCc3ccccn3)/C2=O)ccc1OC

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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 C25H30N4O3S2 MW 498.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O3S2/c1-31-21-7-6-19(17-22(21)32-2)8-12-29-24(30)23(34-25(29)33)18-28-15-13-27(14-16-28)11-9-20-5-3-4-10-26-20/h3-7,10,17-18H,8-9,11-16H2,1-2H3/b23-18-
InChIKey
ZGRFAZSXAIMTTR-NKFKGCMQSA-N
Synonyms

(5Z)3(2(34dimethoxyphenyl)ethyl)5((4(2(pyridin2yl)ethyl)piperazin1yl)methylidene)2thioxo13thiazolidin4one
(5Z)3(2(34dimethoxyphenyl)ethyl)5((4(2pyridin2ylethyl)piperazin1yl)methylidene)2sulfanylidene13thiazolidin4one
(E)3(34dimethoxyphenethyl)5((4(2(pyridin2yl)ethyl)piperazin1yl)methylene)2thioxothiazolidin4one
COC1=C(C=C(C=C1)CCN2C(=O)C(=CN3CCN(CC3)CCC4=CC=CC=N4)SC2=S)OC
COc1cc(CCN2C(=S)SC(=CN3CCN(CC3)CCc3ccccn3)C2=O)ccc1OC
InChI=1SC25H30N4O3S2c131217619(1722(21)322)8122924(30)23(3425(29)33)1828151327(141628)11920534102620h37101718H891116H212H3b2318
MFCD13371664
ZINC000030819319
ZINC30819319

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Available files

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