Vitas-M small molecule compound
N-{2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-2-oxoethyl}-N-(2-phenylethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide (non-preferred name)
Catalog ID
STK754273
SMILES COc1ccc(cc1)/C=N/NC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)CCc1ccccc1
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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 C26H27N3O6S MW 509.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6S/c1-33-22-9-7-21(8-10-22)18-27-28-26(30)19-29(14-13-20-5-3-2-4-6-20)36(31,32)23-11-12-24-25(17-23)35-16-15-34-24/h2-12,17-18H,13-16,19H2,1H3,(H,28,30)/b27-18+InChIKey
IHBIMEMNOJDIJW-OVVQPSECSA-NSynonyms
2(23dihydro14benzodioxin6ylsulfonyl(2phenylethyl)amino)N((E)(4methoxyphenyl)methylideneamino)acetamide
COC1=CC=C(C=C1)C=NNC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4
COc1ccc(cc1)C=NNC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)CCc1ccccc1
InChI=1SC26H27N3O6Sc133229721(81022)18272826(30)1929(1413205324620)36(3132)2311122425(1723)3516153424h2121718H131619H21H3(H2830)b2718+
MFCD00684442
N(2((2E)2(4methoxybenzylidene)hydrazinyl)2oxoethyl)N(2phenylethyl)23dihydro14benzodioxine6sulfonamide(nonpreferredname)
N(2(2(4METHOXYBENZYLIDENE)HYDRAZINO)2OXOETHYL)N(2PHENYLETHYL)23DIHYDRO14BENZODIOXINE6SULFONAMIDE
ZINC000003058214
ZINC33909939
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