Vitas-M small molecule compound

ethyl 5-acetyl-4-methyl-2-{[(naphthalen-2-yloxy)acetyl]amino}thiophene-3-carboxylate

Catalog ID
STK440579
SMILES CCOC(=O)c1c(NC(=O)COc2ccc3c(c2)cccc3)sc(c1C)C(=O)C

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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 C22H21NO5S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S/c1-4-27-22(26)19-13(2)20(14(3)24)29-21(19)23-18(25)12-28-17-10-9-15-7-5-6-8-16(15)11-17/h5-11H,4,12H2,1-3H3,(H,23,25)
InChIKey
ZIPVSTXDAJVHIQ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)COC2=CC3=CC=CC=C3C=C2
ethyl5acetyl4methyl2(((naphthalen2yloxy)acetyl)amino)thiophene3carboxylate
ETHYL5ACETYL4METHYL2((2NAPHTHALEN2YLOXYACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5ACETYL4METHYL2(2(2NAPHTHYLOXY)ACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC22H21NO5Sc142722(26)1913(2)20(14(3)24)2921(19)2318(25)12281710915756816(15)1117h511H412H213H3(H2325)
MFCD03388459
ZINC000002794928
ZINC02794928
ZINC2794928

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Available files

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