Vitas-M small molecule compound
(5E)-5-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methylidene}-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK719306
SMILES S=C1S/C(=C/N2CCN(CC2)Cc2ccc3c(c2)OCO3)/C(=O)N1CC1CCCO1
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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 C21H25N3O4S2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S2/c25-20-19(30-21(29)24(20)12-16-2-1-9-26-16)13-23-7-5-22(6-8-23)11-15-3-4-17-18(10-15)28-14-27-17/h3-4,10,13,16H,1-2,5-9,11-12,14H2/b19-13+InChIKey
WQYSHHVCGHXWTG-CPNJWEJPSA-NSynonyms
929850-52-2(5E)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(oxolan2ylmethyl)2sulfanylidene13thiazolidin4one
(5E)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(tetrahydrofuran2ylmethyl)2thioxo13thiazolidin4one
(E)5((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methylene)3((tetrahydrofuran2yl)methyl)2thioxothiazolidin4one
929850522
C1CC(OC1)CN2C(=O)C(=CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)SC2=S
InChI=1SC21H25N3O4S2c252019(3021(29)24(20)12162192616)13237522(6823)1115341718(1015)28142717h34101316H1259111214H2b1913+
MFCD09792372
S=C1SC(=CN2CCN(CC2)Cc2ccc3c(c2)OCO3)C(=O)N1CC1CCCO1
ZINC000101483283
ZINC000101483285
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