Vitas-M small molecule compound

3-[(3E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-4,6-dichloro-3-hydroxy-1,3-dihydro-2H-indol-2-one

Catalog ID
STL234771
SMILES O=C(CC1(O)C(=O)Nc2c1c(Cl)cc(c2)Cl)/C=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 C19H13Cl2NO5 MW 406.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl2NO5/c20-11-6-13(21)17-14(7-11)22-18(24)19(17,25)8-12(23)3-1-10-2-4-15-16(5-10)27-9-26-15/h1-7,25H,8-9H2,(H,22,24)/b3-1+
InChIKey
AZPAAXYULBUSAM-HNQUOIGGSA-N
Synonyms
847340-64-1
(E)3(4(benzo(d)(13)dioxol5yl)2oxobut3en1yl)46dichloro3hydroxyindolin2one
3((3E)4(13benzodioxol5yl)2oxobut3en1yl)46dichloro3hydroxy13dihydro2Hindol2one
3((E)4(13BENZODIOXOL5YL)2OXOBUT3ENYL)46DICHLORO3HYDROXY1HINDOL2ONE
847340641
C1OC2=C(O1)C=C(C=C2)C=CC(=O)CC3(C4=C(C=C(C=C4NC3=O)Cl)Cl)O
InChI=1SC19H13Cl2NO5c2011613(21)1714(711)2218(24)19(1725)812(23)3110241516(510)2792615h1725H89H2(H2224)b31+
MFCD04180331
O=C(CC1(O)C(=O)Nc2c1c(Cl)cc(c2)Cl)C=Cc1ccc2c(c1)OCO2
ZINC000002222187
ZINC000005159627

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Available files

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