Vitas-M small molecule compound
(5Z)-5-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methylidene}-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL010076
SMILES CC(CN1C(=S)S/C(=C\N2CCN(CC2)Cc2ccc3c(c2)OCO3)/C1=O)C
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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 C20H25N3O3S2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S2/c1-14(2)10-23-19(24)18(28-20(23)27)12-22-7-5-21(6-8-22)11-15-3-4-16-17(9-15)26-13-25-16/h3-4,9,12,14H,5-8,10-11,13H2,1-2H3/b18-12-InChIKey
CLVCRHPFKAICSM-PDGQHHTCSA-NSynonyms
929867-02-7(5Z)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(2methylpropyl)2sulfanylidene13thiazolidin4one
(5Z)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(2methylpropyl)2thioxo13thiazolidin4one
(Z)5((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methylene)3isobutyl2thioxothiazolidin4one
929867027
CC(C)CN1C(=O)C(=CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)SC1=S
CC(CN1C(=S)SC(=CN2CCN(CC2)Cc2ccc3c(c2)OCO3)C1=O)C
InChI=1SC20H25N3O3S2c114(2)102319(24)18(2820(23)27)12227521(6822)1115341617(915)26132516h3491214H58101113H212H3b1812
MFCD09844819
ZINC000032046727
ZINC32046727
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