Vitas-M small molecule compound
ethyl (7E)-2-(acetylamino)-7-[(acetyloxy)imino]-6-(phenylsulfanyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK995685
SMILES CCOC(=O)c1c(NC(=O)C)sc2c1CCC(/C/2=N\OC(=O)C)Sc1ccccc1
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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 C21H22N2O5S2 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5S2/c1-4-27-21(26)17-15-10-11-16(29-14-8-6-5-7-9-14)18(23-28-13(3)25)19(15)30-20(17)22-12(2)24/h5-9,16H,4,10-11H2,1-3H3,(H,22,24)/b23-18+InChIKey
YUIDIOPDAPTYIF-PTGBLXJZSA-NSynonyms
948265-38-1948265381
CCOC(=O)c1c(NC(=O)C)sc2c1CCC(C2=NOC(=O)C)Sc1ccccc1
ethyl(7E)2(acetylamino)7((acetyloxy)imino)6(phenylsulfanyl)4567tetrahydro1benzothiophene3carboxylate
MFCD01992821
ZINC000009943187
ZINC000009943190
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