Vitas-M small molecule compound
4-oxo-2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Catalog ID
STK761099
SMILES N#CC1C(=O)NC(=C(C21CCCCC2)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 C23H19N3O4S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S/c24-11-16-20(28)26-21(17(12-25)23(16)8-4-1-5-9-23)31-13-18(27)15-10-14-6-2-3-7-19(14)30-22(15)29/h2-3,6-7,10,16H,1,4-5,8-9,13H2,(H,26,28)InChIKey
TXRGIHKXYQWHIL-UHFFFAOYSA-NSynonyms
2oxo4(2oxo2(2oxochromen3yl)ethyl)sulfanyl3azaspiro(55)undec4ene15dicarbonitrile
4oxo2((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)3azaspiro(55)undec1ene15dicarbonitrile
8OXO10(2OXO2(2OXOCHROMEN3YL)ETHYL)SULFANYL9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N
InChI=1SC23H19N3O4Sc24111620(28)2621(17(1225)23(16)8415923)311318(27)151014623719(14)3022(15)29h23671016H1458913H2(H2628)
MFCD00331553
ZINC000000652704
ZINC000000652706
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