Vitas-M small molecule compound
prop-2-en-1-yl 6'-amino-5'-cyano-1-(2-ethoxy-2-oxoethyl)-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STL015943
SMILES C=CCOC(=O)C1=C(C)OC(=C(C21c1ccccc1N(C2=O)CC(=O)OCC)C#N)N
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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 C22H21N3O6 MW 423.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O6/c1-4-10-30-20(27)18-13(3)31-19(24)15(11-23)22(18)14-8-6-7-9-16(14)25(21(22)28)12-17(26)29-5-2/h4,6-9H,1,5,10,12,24H2,2-3H3InChIKey
WDSHPPHWXDBRIP-UHFFFAOYSA-NSynonyms
445222-84-4(R)allyl2amino3cyano1(2ethoxy2oxoethyl)6methyl2oxospiro(indoline34pyran)5carboxylate
445222844
ALLYL6AMINO5CYANO1(2ETHOXY2OXOETHYL)2METHYL2OXOSPIRO(4HPYRAN43(2H)INDOLE)3CARBOXYLATE
CCOC(=O)CN1C2=CC=CC=C2C3(C1=O)C(=C(OC(=C3C(=O)OCC=C)C)N)C#N
InChI=1SC22H21N3O6c14103020(27)1813(3)3119(24)15(1123)22(18)14867916(14)25(21(22)28)1217(26)2952h469H15101224H223H3
MFCD02949236
prop2en1yl6amino5cyano1(2ethoxy2oxoethyl)2methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
PROP2ENYL6AMINO5CYANO1(2ETHOXY2OXOETHYL)2METHYL2OXOSPIRO(INDOLE34PYRAN)3CARBOXYLATE
ZINC000001756566
ZINC000001756568
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