Vitas-M small molecule compound
N-(4-fluorophenyl)-N-{2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-2-oxoethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide (non-preferred name)
Catalog ID
STL280582
SMILES COc1ccc(cc1)/C=N/NC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(cc1)F
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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 C24H22FN3O6S MW 499.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN3O6S/c1-32-20-8-2-17(3-9-20)15-26-27-24(29)16-28(19-6-4-18(25)5-7-19)35(30,31)21-10-11-22-23(14-21)34-13-12-33-22/h2-11,14-15H,12-13,16H2,1H3,(H,27,29)/b26-15+InChIKey
KCEQVKCYLNEYCO-CVKSISIWSA-NSynonyms
2(N(23DIHYDRO14BENZODIOXIN6YLSULFONYL)4FLUOROANILINO)N((E)(4METHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
COC1=CC=C(C=C1)C=NNC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC4=C(C=C3)OCCO4
COc1ccc(cc1)C=NNC(=O)CN(S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccc(cc1)F
InChI=1SC24H22FN3O6Sc132208217(3920)15262724(29)1628(196418(25)5719)35(3031)2110112223(1421)3413123322h2111415H121316H21H3(H2729)b2615+
MFCD01628655
N(4fluorophenyl)N(2((2E)2(4methoxybenzylidene)hydrazinyl)2oxoethyl)23dihydro14benzodioxine6sulfonamide(nonpreferredname)
ZINC000002621713
ZINC33376920
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