Vitas-M small molecule compound

methyl 3-{[(3-ethyl-7-hydroxy-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]methyl}-4-methoxybenzoate

Catalog ID
STK600858
SMILES COC(=O)c1ccc(c(c1)CSc1nc(O)c2c(n1)n(CC)c(=S)s2)OC

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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 C17H17N3O4S3 MW 423.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4S3/c1-4-20-13-12(27-17(20)25)14(21)19-16(18-13)26-8-10-7-9(15(22)24-3)5-6-11(10)23-2/h5-7H,4,8H2,1-3H3,(H,18,19,21)
InChIKey
XBBMZAIUEZLFBP-UHFFFAOYSA-N
Synonyms
895836-19-8
895836198
MFCD08733977
ZINC000009410408

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Available files

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