Vitas-M small molecule compound

ethyl 4-{[(2Z,5E)-5-(1H-indol-3-ylmethylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate

Catalog ID
STK104672
SMILES CCOC(=O)c1ccc(cc1)/N=C/1\S/C(=C/c2c[nH]c3c2cccc3)/C(=O)N1C

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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 C22H19N3O3S MW 405.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3S/c1-3-28-21(27)14-8-10-16(11-9-14)24-22-25(2)20(26)19(29-22)12-15-13-23-18-7-5-4-6-17(15)18/h4-13,23H,3H2,1-2H3/b19-12+,24-22-
InChIKey
KXCXZWYLLSIARG-RVFNTIOESA-N
Synonyms

CCOC(=O)c1ccc(cc1)N=C1SC(=Cc2c(nH)c3c2cccc3)C(=O)N1C
ethyl4(((2Z5E)5(1Hindol3ylmethylidene)3methyl4oxo13thiazolidin2ylidene)amino)benzoate
MFCD03271814
ZINC000016247924

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.