Vitas-M small molecule compound

methyl (2E)-3-[(2,4-difluorophenyl)amino]-2-(phenylsulfonyl)prop-2-enoate

Catalog ID
STL133248
SMILES COC(=O)/C(=C\Nc1ccc(cc1F)F)/S(=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 C16H13F2NO4S MW 353.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F2NO4S/c1-23-16(20)15(24(21,22)12-5-3-2-4-6-12)10-19-14-8-7-11(17)9-13(14)18/h2-10,19H,1H3/b15-10+
InChIKey
WHWJEQDZLPSNFN-XNTDXEJSSA-N
Synonyms

COC(=O)C(=CNC1=C(C=C(C=C1)F)F)S(=O)(=O)C2=CC=CC=C2
COC(=O)C(=CNc1ccc(cc1F)F)S(=O)(=O)c1ccccc1
InChI=1SC16H13F2NO4Sc12316(20)15(24(2122)125324612)1019148711(17)913(14)18h21019H1H3b1510+
methyl(2E)3((24difluorophenyl)amino)2(phenylsulfonyl)prop2enoate
methyl(E)2(benzenesulfonyl)3(24difluoroanilino)prop2enoate
MFCD20753569
ZINC000067340330
ZINC67340330

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Available files

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