Vitas-M small molecule compound
methyl 2-({[(4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STK795883
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C20H19N3O4S2 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S2/c1-27-19(26)11-6-2-4-8-13(11)21-15(24)10-28-20-22-17(25)16-12-7-3-5-9-14(12)29-18(16)23-20/h2,4,6,8H,3,5,7,9-10H2,1H3,(H,21,24)(H,22,23,25)InChIKey
FHKNLUUZAQJIGD-UHFFFAOYSA-NSynonyms
489424-26-2COC(=O)c1ccccc1NC(=O)CSc1nc2sc3c(c2c(=O)(nH)1)CCCC3
methyl2((((4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2(2((4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamido)benzoate
MFCD03296939
ZINC000009046302
ZINC09046302
ZINC9046302
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