Vitas-M small molecule compound

ethyl 2-(acetylamino)-7-chloro-6-[(E)-(hydroxyimino)methyl]-1-benzothiophene-3-carboxylate

Catalog ID
STK279841
SMILES CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2Cl)/C=N/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 C14H13ClN2O4S MW 340.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN2O4S/c1-3-21-14(19)10-9-5-4-8(6-16-20)11(15)12(9)22-13(10)17-7(2)18/h4-6,20H,3H2,1-2H3,(H,17,18)/b16-6+
InChIKey
XGIACSOYPQZQSD-OMCISZLKSA-N
Synonyms
137987-79-2
137987792
CCOC(=O)C1=C(SC2=C1C=CC(=C2Cl)C=NO)NC(=O)C
CCOC(=O)c1c(NC(=O)C)sc2c1ccc(c2Cl)C=NO
ethyl2(acetylamino)7chloro6((E)(hydroxyimino)methyl)1benzothiophene3carboxylate
ethyl2acetamido7chloro6((E)hydroxyiminomethyl)1benzothiophene3carboxylate
InChI=1SC14H13ClN2O4Sc132114(19)109548(61620)11(15)12(9)2213(10)177(2)18h4620H3H212H3(H1718)b166+
MFCD00599138
ZINC000000053354
ZINC102525147

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Available files

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