Vitas-M small molecule compound
4,4-dimethyl-2-oxo-6-(prop-2-en-1-ylsulfanyl)-1,2,3,4-tetrahydropyridine-3,5-dicarbonitrile
Catalog ID
STK387312
SMILES C=CCSC1=C(C#N)C(C(C(=O)N1)C#N)(C)C
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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/c1-4-5-17-11-9(7-14)12(2,3)8(6-13)10(16)15-11/h4,8H,1,5H2,2-3H3,(H,15,16)InChIKey
MTCAWEXPGWORMN-UHFFFAOYSA-NSynonyms
201733-67-7201733677
44dimethyl2oxo6(prop2en1ylsulfanyl)1234tetrahydropyridine35dicarbonitrile
44DIMETHYL2OXO6PROP2ENYLSULFANYL13DIHYDROPYRIDINE35DICARBONITRILE
44DIMETHYL6OXO2PROP2ENYLTHIO145TRIHYDROPYRIDINE35DICARBONITRILE
CC1(C(C(=O)NC(=C1C#N)SCC=C)C#N)C
InChI=1SC12H13N3OSc14517119(714)12(23)8(613)10(16)1511h48H15H223H3(H1516)
MFCD00812607
ZINC000003682893
ZINC000003682894
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