Vitas-M small molecule compound
N-benzyl-N-{2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-2-oxoethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide (non-preferred name)
Catalog ID
STK754716
SMILES COc1ccc(cc1)/C=N/NC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)Cc1ccccc1
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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 C25H25N3O6S MW 495.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O6S/c1-32-21-9-7-19(8-10-21)16-26-27-25(29)18-28(17-20-5-3-2-4-6-20)35(30,31)22-11-12-23-24(15-22)34-14-13-33-23/h2-12,15-16H,13-14,17-18H2,1H3,(H,27,29)/b26-16+InChIKey
ZEXZRUPBNIXOJK-WGOQTCKBSA-NSynonyms
2(BENZYL(23DIHYDRO14BENZODIOXIN6YLSULFONYL)AMINO)N((E)(4METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
23DIHYDROBENZO(14)DIOXINE6SULFONICACIDBENZYL(4METHOXYBENZYLIDENEHYDRAZINOCARBONYLMETHYL)AMIDE
COC1=CC=C(C=C1)C=NNC(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4
COc1ccc(cc1)C=NNC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)Cc1ccccc1
InChI=1SC25H25N3O6Sc132219719(81021)16262725(29)1828(17205324620)35(3031)2211122324(1522)3414133323h2121516H13141718H21H3(H2729)b2616+
MFCD00684407
NbenzylN(2((2E)2(4methoxybenzylidene)hydrazinyl)2oxoethyl)23dihydro14benzodioxine6sulfonamide(nonpreferredname)
ZINC000002176772
ZINC33349745
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