Vitas-M small molecule compound
benzyl 2'-amino-5'-cyano-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Catalog ID
STK956932
SMILES N#CC1=C(C)OC(=C(C21C(=O)Nc1c2cccc1)C(=O)OCc1ccccc1)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 C22H17N3O4 MW 387.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4/c1-13-16(11-23)22(15-9-5-6-10-17(15)25-21(22)27)18(19(24)29-13)20(26)28-12-14-7-3-2-4-8-14/h2-10H,12,24H2,1H3,(H,25,27)InChIKey
CYAWPIFGHSJJJT-UHFFFAOYSA-NSynonyms
2AMINO3((BENZYLOXY)CARBONYL)5CYANO13DIHYDRO6METHYL2OXOSPIRO(4HPYRAN43(2H)INDOLE)
benzyl2amino5cyano6methyl2oxo12dihydrospiro(indole34pyran)3carboxylate
BENZYL2AMINO5CYANO6METHYL2OXOSPIRO(1HINDOLE34PYRAN)3CARBOXYLATE
BENZYL6AMINO3CYANO2METHYL2OXO12DIHYDROSPIRO(INDOLE34PYRAN)5CARBOXYLATE
CC1=C(C2(C3=CC=CC=C3NC2=O)C(=C(O1)N)C(=O)OCC4=CC=CC=C4)C#N
InChI=1SC22H17N3O4c11316(1123)22(159561017(15)2521(22)27)18(19(24)2913)20(26)2812147324814h210H1224H21H3(H2527)
MFCD01244368
ZINC000000647619
ZINC000000647621
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