Vitas-M small molecule compound
4-hydroxy-2-(methylsulfanyl)-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarbonitrile
Catalog ID
STK848234
SMILES N#CC1C(=NC(=C(C21CCCCC2)C#N)SC)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 C13H15N3OS MW 261.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3OS/c1-18-12-10(8-15)13(5-3-2-4-6-13)9(7-14)11(17)16-12/h9H,2-6H2,1H3,(H,16,17)InChIKey
IHTPWWVPPIKLKZ-UHFFFAOYSA-NSynonyms
185414-65-710METHYLSULFANYL8OXO9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
185414657
2METHYLSULFANYL4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
4hydroxy2(methylsulfanyl)3azaspiro(55)undeca13diene15dicarbonitrile
4methylsulfanyl2oxo3azaspiro(55)undec4ene15dicarbonitrile
CSC1=C(C2(CCCCC2)C(C(=O)N1)C#N)C#N
InChI=1SC13H15N3OSc1181210(815)13(5324613)9(714)11(17)1612h9H26H21H3(H1617)
MFCD07199307
ZINC000009108661
ZINC000009108662
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