Vitas-M small molecule compound
(5Z)-3-ethyl-5-{[1-(4-nitrobenzyl)-1H-indol-3-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK049779
SMILES CCN1C(=S)S/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)[N+](=O)[O-])/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 C21H17N3O3S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3S2/c1-2-23-20(25)19(29-21(23)28)11-15-13-22(18-6-4-3-5-17(15)18)12-14-7-9-16(10-8-14)24(26)27/h3-11,13H,2,12H2,1H3/b19-11-InChIKey
AMGIQLKWZMQMHE-ODLFYWEKSA-NSynonyms
(5Z)3ETHYL5((1((4NITROPHENYL)METHYL)INDOL3YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)3ETHYL5((1(4NITROBENZYL)1HINDOL3YL)METHYLIDENE)2THIOXO13THIAZOLIDIN4ONE
CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)(N+)(=O)(O))SC1=S
CCN1C(=S)SC(=Cc2cn(c3c2cccc3)Cc2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC21H17N3O3S2c122320(25)19(2921(23)28)11151322(18643517(15)18)12147916(10814)24(26)27h31113H212H21H3b1911
MFCD01963884
STK049779
ZINC000002185220
ZINC02185220
ZINC2185220
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