Vitas-M small molecule compound
9-oxo-7-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-8-azaspiro[4.5]dec-6-ene-6,10-dicarbonitrile
Catalog ID
STK833850
SMILES N#CC1C(=O)NC(=C(C21CCCC2)C#N)SCC(=O)c1cc2ccccc2oc1=O
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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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c23-10-15-19(27)25-20(16(11-24)22(15)7-3-4-8-22)30-12-17(26)14-9-13-5-1-2-6-18(13)29-21(14)28/h1-2,5-6,9,15H,3-4,7-8,12H2,(H,25,27)InChIKey
HSYQDFBBIQXQIR-UHFFFAOYSA-NSynonyms
4594-55-24594552
7OXO9(2OXO2(2OXOCHROMEN3YL)ETHYL)SULFANYL8AZASPIRO(45)DEC9ENE610DICARBONITRILE
9oxo7((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)8azaspiro(45)dec6ene610dicarbonitrile
9oxo7((2oxo2(2oxo2Hchromen3yl)ethyl)thio)8azaspiro(45)dec6ene610dicarbonitrile
C1CCC2(C1)C(C(=O)NC(=C2C#N)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N
InChI=1SC22H17N3O4Sc23101519(27)2520(16(1124)22(15)734822)301217(26)14913512618(13)2921(14)28h1256915H347812H2(H2527)
MFCD00559068
ZINC000008996180
ZINC000017044149
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