Vitas-M small molecule compound
(5Z)-3-(2-ethylhexyl)-5-[4-(propan-2-yl)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK822535
SMILES CCCCC(CN1C(=S)S/C(=C\c2ccc(cc2)C(C)C)/C1=O)CC
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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 C21H29NOS2 MW 375.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29NOS2/c1-5-7-8-16(6-2)14-22-20(23)19(25-21(22)24)13-17-9-11-18(12-10-17)15(3)4/h9-13,15-16H,5-8,14H2,1-4H3/b19-13-InChIKey
NVCSQGBIBSGDIP-UYRXBGFRSA-NSynonyms
(5Z)3(2ethylhexyl)5((4propan2ylphenyl)methylidene)2sulfanylidene13thiazolidin4one
(5Z)3(2ethylhexyl)5(4(propan2yl)benzylidene)2thioxo13thiazolidin4one
CCCCC(CC)CN1C(=O)C(=CC2=CC=C(C=C2)C(C)C)SC1=S
CCCCC(CN1C(=S)SC(=Cc2ccc(cc2)C(C)C)C1=O)CC
InChI=1SC21H29NOS2c157816(62)142220(23)19(2521(22)24)131791118(121017)15(3)4h9131516H5814H214H3b1913
MFCD03212116
ZINC000005862462
ZINC000005862593
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