Vitas-M small molecule compound
N-{2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-2-oxoethyl}-4-fluoro-N-(4-methylphenyl)benzenesulfonamide (non-preferred name)
Catalog ID
STL137640
SMILES O=C(CN(S(=O)(=O)c1ccc(cc1)F)c1ccc(cc1)C)N/N=C/c1ccc2c(c1)OCO2
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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 C23H20FN3O5S MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O5S/c1-16-2-7-19(8-3-16)27(33(29,30)20-9-5-18(24)6-10-20)14-23(28)26-25-13-17-4-11-21-22(12-17)32-15-31-21/h2-13H,14-15H2,1H3,(H,26,28)/b25-13+InChIKey
YGVQYUAAMSQFAI-DHRITJCHSA-NSynonyms
CC1=CC=C(C=C1)N(CC(=O)NN=CC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)F
InChI=1SC23H20FN3O5Sc1162719(8316)27(33(2930)209518(24)61020)1423(28)262513174112122(1217)32153121h213H1415H21H3(H2628)b2513+
MFCD02060249
N((1E)2(2HBENZO(34D)13DIOXOLAN5YL)1AZAVINYL)2(((4FLUOROPHENYL)SULFONYL)(4METHYLPHENYL)AMINO)ACETAMIDE
N((E)13benzodioxol5ylmethylideneamino)2(N(4fluorophenyl)sulfonyl4methylanilino)acetamide
N(2((2E)2(13benzodioxol5ylmethylidene)hydrazinyl)2oxoethyl)4fluoroN(4methylphenyl)benzenesulfonamide(nonpreferredname)
O=C(CN(S(=O)(=O)c1ccc(cc1)F)c1ccc(cc1)C)NN=Cc1ccc2c(c1)OCO2
ZINC000016292538
ZINC83317969
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