Vitas-M small molecule compound

methyl 4-{[({3-[(phenylsulfonyl)methyl]-1,2,4-oxadiazol-5-yl}carbonyl)amino]methyl}benzoate

Catalog ID
STK783371
SMILES COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)CS(=O)(=O)c1ccccc1

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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 C19H17N3O6S MW 415.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O6S/c1-27-19(24)14-9-7-13(8-10-14)11-20-17(23)18-21-16(22-28-18)12-29(25,26)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,20,23)
InChIKey
MIQDWYNIJHXDIQ-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3
InChI=1SC19H17N3O6Sc12719(24)149713(81014)112017(23)182116(222818)1229(2526)155324615h210H1112H21H3(H2023)
methyl4((((3((phenylsulfonyl)methyl)124oxadiazol5yl)carbonyl)amino)methyl)benzoate
METHYL4(((3(BENZENESULFONYLMETHYL)124OXADIAZOLE5CARBONYL)AMINO)METHYL)BENZOATE
MFCD06618117
ZINC000004745639
ZINC04745639
ZINC4745639

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Available files

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