Vitas-M small molecule compound

(2E)-4-oxo-4-[2-oxo-5'-(thiophen-2-yl)-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]but-2-enoic acid

Catalog ID
STK607546
SMILES OC(=O)/C=C/C(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1cccs1

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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 C18H13N3O4S MW 367.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O4S/c22-15(7-8-16(23)24)21-18(10-13(20-21)14-6-3-9-26-14)11-4-1-2-5-12(11)19-17(18)25/h1-9H,10H2,(H,19,25)(H,23,24)/b8-7+
InChIKey
WQJYUFZTPJGUNJ-BQYQJAHWSA-N
Synonyms
929871-20-5
(2E)4oxo4(2oxo5(thiophen2yl)12dihydrospiro(indole33pyrazol)2(4H)yl)but2enoicacid
(E)4oxo4(2oxo3thiophen2ylspiro(1Hindole354Hpyrazole)1yl)but2enoicacid
(E)4oxo4(2oxo5(thiophen2yl)spiro(indoline33pyrazol)2(4H)yl)but2enoicacid
C1C(=NN(C12C3=CC=CC=C3NC2=O)C(=O)C=CC(=O)O)C4=CC=CS4
OC(=O)C=CC(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1cccs1
Registry IDs
MFCD08749357
ZINC000013629619
ZINC000013629621

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Available files

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