Vitas-M small molecule compound

ethyl 6'-amino-5'-cyano-2'-methyl-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate

Catalog ID
STK863588
SMILES C=CCN1c2ccccc2C2(C1=O)C(=C(C)OC(=C2C#N)N)C(=O)OCC

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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 C20H19N3O4 MW 365.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4/c1-4-10-23-15-9-7-6-8-13(15)20(19(23)25)14(11-21)17(22)27-12(3)16(20)18(24)26-5-2/h4,6-9H,1,5,10,22H2,2-3H3
InChIKey
NTSKFSUYRBOBBZ-UHFFFAOYSA-N
Synonyms
352663-38-8
(R)ethyl1allyl2amino3cyano6methyl2oxospiro(indoline34pyran)5carboxylate
1ALLYL6AMINO5CYANO13DIHYDRO3ETHOXYCARBONYL2METHYL2OXOSPIRO(2HINDOLE34(4H)PYRAN)
352663388
CCOC(=O)C1=C(OC(=C(C12C3=CC=CC=C3N(C2=O)CC=C)C#N)N)C
ETHYL(3R)6AMINO5CYANO2METHYL2OXO1(PROP2EN1YL)12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
ETHYL(3S)6AMINO5CYANO2METHYL2OXO1(PROP2EN1YL)12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
ethyl6amino5cyano2methyl2oxo1(prop2en1yl)12dihydrospiro(indole34pyran)3carboxylate
ETHYL6AMINO5CYANO2METHYL2OXO1PROP2EN1YL12DIHYDROSPIRO(INDOLE34PYRAN)3CARBOXYLATE
ETHYL6AMINO5CYANO2METHYL2OXO1PROP2ENYLSPIRO(INDOLE34PYRAN)3CARBOXYLATE
InChI=1SC20H19N3O4c14102315976813(15)20(19(23)25)14(1121)17(22)2712(3)16(20)18(24)2652h469H151022H223H3
MFCD01928686
ZINC000000989375
ZINC000000989376

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.