Vitas-M small molecule compound
(2E)-4-[5'-(2,4-dichlorophenyl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]-4-oxobut-2-enoic acid
Catalog ID
STK609504
SMILES OC(=O)/C=C/C(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1ccc(cc1Cl)Cl
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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 C20H13Cl2N3O4 MW 430.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13Cl2N3O4/c21-11-5-6-12(14(22)9-11)16-10-20(25(24-16)17(26)7-8-18(27)28)13-3-1-2-4-15(13)23-19(20)29/h1-9H,10H2,(H,23,29)(H,27,28)/b8-7+InChIKey
VVEXMONEQMCSEK-BQYQJAHWSA-NSynonyms
929841-74-7(2E)4(5(24dichlorophenyl)2oxo12dihydrospiro(indole33pyrazol)2(4H)yl)4oxobut2enoicacid
(E)4(3(24dichlorophenyl)2oxospiro(1Hindole354Hpyrazole)1yl)4oxobut2enoicacid
(E)4(5(24dichlorophenyl)2oxospiro(indoline33pyrazol)2(4H)yl)4oxobut2enoicacid
929841747
C1C(=NN(C12C3=CC=CC=C3NC2=O)C(=O)C=CC(=O)O)C4=C(C=C(C=C4)Cl)Cl
InChI=1SC20H13Cl2N3O4c21115612(14(22)911)161020(25(2416)17(26)7818(27)28)13312415(13)2319(20)29h19H10H2(H2329)(H2728)b87+
MFCD08749692
OC(=O)C=CC(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1ccc(cc1Cl)Cl
ZINC000009418499
ZINC000009418500
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