Vitas-M small molecule compound
methyl (2E)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-(phenylsulfonyl)prop-2-enoate
Catalog ID
STL133247
SMILES COC(=O)/C(=C\Nc1ccc2c(c1)OCCO2)/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 C18H17NO6S MW 375.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO6S/c1-23-18(20)17(26(21,22)14-5-3-2-4-6-14)12-19-13-7-8-15-16(11-13)25-10-9-24-15/h2-8,11-12,19H,9-10H2,1H3/b17-12+InChIKey
VHODYJXXEAOQKY-SFQUDFHCSA-NSynonyms
COC(=O)C(=CNC1=CC2=C(C=C1)OCCO2)S(=O)(=O)C3=CC=CC=C3
COC(=O)C(=CNc1ccc2c(c1)OCCO2)S(=O)(=O)c1ccccc1
InChI=1SC18H17NO6Sc12318(20)17(26(2122)145324614)121913781516(1113)251092415h28111219H910H21H3b1712+
methyl(2E)3(23dihydro14benzodioxin6ylamino)2(phenylsulfonyl)prop2enoate
methyl(E)2(benzenesulfonyl)3(23dihydro14benzodioxin6ylamino)prop2enoate
MFCD20753568
ZINC000067340329
ZINC67340329
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