Vitas-M small molecule compound
(5Z)-5-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methylidene}-3-(3-methylbutyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK719315
SMILES CC(CCN1C(=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 C21H27N3O3S2 MW 433.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S2/c1-15(2)5-6-24-20(25)19(29-21(24)28)13-23-9-7-22(8-10-23)12-16-3-4-17-18(11-16)27-14-26-17/h3-4,11,13,15H,5-10,12,14H2,1-2H3/b19-13-InChIKey
CITDIKQDXALSGG-UYRXBGFRSA-NSynonyms
(5Z)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(3methylbutyl)2sulfanylidene13thiazolidin4one
(5Z)5((4(13benzodioxol5ylmethyl)piperazin1yl)methylidene)3(3methylbutyl)2thioxo13thiazolidin4one
(E)5((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methylene)3isopentyl2thioxothiazolidin4one
CC(C)CCN1C(=O)C(=CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)SC1=S
CC(CCN1C(=S)SC(=CN2CCN(CC2)Cc2ccc3c(c2)OCO3)C1=O)C
InChI=1SC21H27N3O3S2c115(2)562420(25)19(2921(24)28)13239722(81023)1216341718(1116)27142617h34111315H5101214H212H3b1913
MFCD13371670
ZINC000030819353
ZINC30819353
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