Vitas-M small molecule compound
4-oxo-2-sulfanyl-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Catalog ID
STL352984
SMILES N#CC1C(=O)NC(=C(C21CCCCC2)C#N)S
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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 C12H13N3OS MW 247.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3OS/c13-6-8-10(16)15-11(17)9(7-14)12(8)4-2-1-3-5-12/h8,17H,1-5H2,(H,15,16)InChIKey
YQJCLTNVDXLQLO-UHFFFAOYSA-NSynonyms
185414-44-2185414442
2MERCAPTO4OXO3AZASPIRO(55)UNDEC1ENE15DICARBONITRILE
2oxo4sulfanyl3azaspiro(55)undec4ene15dicarbonitrile
4oxo2sulfanyl3azaspiro(55)undec1ene15dicarbonitrile
8OXO10SULFANYL9AZASPIRO(55)UNDEC10ENE711DICARBONITRILE
C1CCC2(CC1)C(C(=O)NC(=C2C#N)S)C#N
InChI=1SC12H13N3OSc136810(16)1511(17)9(714)12(8)4213512h817H15H2(H1516)
MFCD00559067
ZINC000008972872
ZINC000012667943
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