Vitas-M small molecule compound
methyl [(3E)-3-{2-[(7-tert-butyl-2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl]hydrazinylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl]acetate
Catalog ID
STK181211
SMILES COC(=O)CN1C(=O)/C(=N/NC(=O)C2COc3c(O2)cc(cc3)C(C)(C)C)/c2c1cccc2
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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 C24H25N3O6 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O6/c1-24(2,3)14-9-10-17-18(11-14)33-19(13-32-17)22(29)26-25-21-15-7-5-6-8-16(15)27(23(21)30)12-20(28)31-4/h5-11,19H,12-13H2,1-4H3,(H,26,29)/b25-21+InChIKey
XIPOXJMWNUWMRF-NJNXFGOHSA-NSynonyms
(E)methyl2(3(2(7(tertbutyl)23dihydrobenzo(b)(14)dioxine2carbonyl)hydrazono)2oxoindolin1yl)acetate
CC(C)(C)C1=CC2=C(C=C1)OCC(O2)C(=O)NN=C3C4=CC=CC=C4N(C3=O)CC(=O)OC
COC(=O)CN1C(=O)C(=NNC(=O)C2COc3c(O2)cc(cc3)C(C)(C)C)c2c1cccc2
InChI=1SC24H25N3O6c124(23)149101718(1114)3319(133217)22(29)26252115756816(15)27(23(21)30)1220(28)314h51119H1213H214H3(H2629)b2521+
METHYL((3E)3(2((7TERTBUTYL23DIHYDRO14BENZODIOXIN2YL)CARBONYL)HYDRAZINYLIDENE)2OXO23DIHYDRO1HINDOL1YL)ACETATE
methyl2((3E)3((6tertbutyl23dihydro14benzodioxine3carbonyl)hydrazinylidene)2oxoindol1yl)acetate
MFCD02911086
ZINC000002309541
ZINC000002309543
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