Vitas-M small molecule compound
5'-acetyl-3'-cyano-6'-methyl-1',2',3',4'-tetrahydro-3,4'-bipyridine-2'-thiolate
Catalog ID
STL058907
SMILES N#CC1C([S-])NC(=C(C1c1cccnc1)C(=O)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 C14H14N3OS MW 272.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3OS/c1-8-12(9(2)18)13(10-4-3-5-16-7-10)11(6-15)14(19)17-8/h3-5,7,11,13-14,17,19H,1-2H3/p-1InChIKey
KFNDLAVULSACJJ-UHFFFAOYSA-MSynonyms
5acetyl3cyano6methyl1234tetrahydro34bipyridine2thiolate
5acetyl3cyano6methyl4pyridin3yl1234tetrahydropyridine2thiolate
C1COCC(NH2+)1N#CC1C((S))NC(=C(C1c1cccnc1)C(=O)C)C
CC1=C(C(C(C(N1)(S))C#N)C2=CN=CC=C2)C(=O)C
InChI=1SC14H15N3OSc1812(9(2)18)13(1043516710)11(615)14(19)178h3571113141719H12H3p1
morpholin4ium5acetyl3cyano6methyl1234tetrahydro(34bipyridine)2thiolate
N#CC1C((S))NC(=C(C1c1cccnc1)C(=O)C)C
ZINC000013739554
ZINC000105296747
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