Vitas-M small molecule compound

ethyl 4-({[5-(phenoxymethyl)-2-thioxo-1,3,4-oxadiazol-3(2H)-yl]acetyl}amino)benzoate

Catalog ID
STL282323
SMILES CCOC(=O)c1ccc(cc1)NC(=O)Cn1nc(oc1=S)COc1ccccc1

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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 C20H19N3O5S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O5S/c1-2-26-19(25)14-8-10-15(11-9-14)21-17(24)12-23-20(29)28-18(22-23)13-27-16-6-4-3-5-7-16/h3-11H,2,12-13H2,1H3,(H,21,24)
InChIKey
BBQOVQBHPXRVNL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=S)OC(=N2)COC3=CC=CC=C3
ethyl4(((5(phenoxymethyl)2thioxo134oxadiazol3(2H)yl)acetyl)amino)benzoate
ETHYL4((2(5(PHENOXYMETHYL)2SULFANYLIDENE134OXADIAZOL3YL)ACETYL)AMINO)BENZOATE
ETHYL4(2(5(PHENOXYMETHYL)2THIOXO134OXADIAZOLIN3YL)ACETYLAMINO)BENZOATE
InChI=1SC20H19N3O5Sc122619(25)1481015(11914)2117(24)122320(29)2818(2223)1327166435716h311H21213H21H3(H2124)
MFCD04316928
ZINC000006956407
ZINC06956407
ZINC6956407

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Available files

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