Vitas-M small molecule compound

2-(methylsulfanyl)-4-(3-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile

Catalog ID
STK725836
SMILES N#CC1=C(SC)NC(=O)CC1c1cccc(c1)[N+](=O)[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 C13H11N3O3S MW 289.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N3O3S/c1-20-13-11(7-14)10(6-12(17)15-13)8-3-2-4-9(5-8)16(18)19/h2-5,10H,6H2,1H3,(H,15,17)
InChIKey
JRCMYKQFTZWLKD-UHFFFAOYSA-N
Synonyms
350692-63-6
2(methylsulfanyl)4(3nitrophenyl)6oxo1456tetrahydropyridine3carbonitrile
2(methylthio)4(3nitrophenyl)6oxo1456tetrahydropyridine3carbonitrile
350692636
6METHYLSULFANYL4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CSC1=C(C(CC(=O)N1)C2=CC(=CC=C2)(N+)(=O)(O))C#N
InChI=1SC13H11N3O3Sc1201311(714)10(612(17)1513)83249(58)16(18)19h2510H6H21H3(H1517)
MFCD01820276
N#CC1=C(SC)NC(=O)CC1c1cccc(c1)(N+)(=O)(O)
ZINC000009109549
ZINC000009109550

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Available files

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