Vitas-M small molecule compound

(2E)-3-{3-[(2-hydroxyethyl)(methyl)sulfamoyl]-4-methoxyphenyl}prop-2-enoic acid

Catalog ID
STK806872
SMILES OCCN(S(=O)(=O)c1cc(/C=C/C(=O)O)ccc1OC)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 C13H17NO6S MW 315.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO6S/c1-14(7-8-15)21(18,19)12-9-10(4-6-13(16)17)3-5-11(12)20-2/h3-6,9,15H,7-8H2,1-2H3,(H,16,17)/b6-4+
InChIKey
NYYAHTIJXTWLML-GQCTYLIASA-N
Synonyms
327094-28-0
(2E)3(3(((2HYDROXYETHYL)METHYLAMINO)SULFONYL)4METHOXYPHENYL)PROP2ENOICACID
(2E)3(3((2hydroxyethyl)(methyl)sulfamoyl)4methoxyphenyl)prop2enoicacid
(E)3(3(2HYDROXYETHYL(METHYL)SULFAMOYL)4METHOXYPHENYL)PROP2ENOICACID
(E)3(3(N(2hydroxyethyl)Nmethylsulfamoyl)4methoxyphenyl)acrylicacid
327094280
CN(CCO)S(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)O)OC
InChI=1SC13H17NO6Sc114(7815)21(1819)12910(4613(16)17)3511(12)202h36915H78H212H3(H1617)b64+
MFCD02659598
OCCN(S(=O)(=O)c1cc(C=CC(=O)O)ccc1OC)C
ZINC000000168069
ZINC168069

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Available files

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