Vitas-M small molecule compound
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-({[2-(piperidin-1-yl)phenyl]amino}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK719326
SMILES COc1ccc(cc1OC)CCN1C(=S)S/C(=C/Nc2ccccc2N2CCCCC2)/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 C25H29N3O3S2 MW 483.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O3S2/c1-30-21-11-10-18(16-22(21)31-2)12-15-28-24(29)23(33-25(28)32)17-26-19-8-4-5-9-20(19)27-13-6-3-7-14-27/h4-5,8-11,16-17,26H,3,6-7,12-15H2,1-2H3/b23-17+InChIKey
JHBJFLYMZGSERY-HAVVHWLPSA-NSynonyms
(5E)3(2(34dimethoxyphenyl)ethyl)5(((2(piperidin1yl)phenyl)amino)methylidene)2thioxo13thiazolidin4one
(5E)3(2(34dimethoxyphenyl)ethyl)5((2piperidin1ylanilino)methylidene)2sulfanylidene13thiazolidin4one
(E)3(34dimethoxyphenethyl)5(((2(piperidin1yl)phenyl)amino)methylene)2thioxothiazolidin4one
COC1=C(C=C(C=C1)CCN2C(=O)C(=CNC3=CC=CC=C3N4CCCCC4)SC2=S)OC
COc1ccc(cc1OC)CCN1C(=S)SC(=CNc2ccccc2N2CCCCC2)C1=O
InChI=1SC25H29N3O3S2c13021111018(1622(21)312)12152824(29)23(3325(28)32)172619845920(19)27136371427h45811161726H3671215H212H3b2317+
MFCD09794967
ZINC000008993080
ZINC08993080
ZINC8993080
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