Vitas-M small molecule compound

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

Catalog ID
STK885725
SMILES CCSC1=C(C#N)C(CC(=O)N1)c1cccc(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 C14H13N3O3S MW 303.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O3S/c1-2-21-14-12(8-15)11(7-13(18)16-14)9-4-3-5-10(6-9)17(19)20/h3-6,11H,2,7H2,1H3,(H,16,18)
InChIKey
LSTOEXRFQJJFRK-UHFFFAOYSA-N
Synonyms

2(ethylsulfanyl)4(3nitrophenyl)6oxo1456tetrahydropyridine3carbonitrile
2(ethylthio)4(3nitrophenyl)6oxo1456tetrahydropyridine3carbonitrile
6ETHYLSULFANYL4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBONITRILE
CCSC1=C(C#N)C(CC(=O)N1)c1cccc(c1)(N+)(=O)(O)
CCSC1=C(C(CC(=O)N1)C2=CC(=CC=C2)(N+)(=O)(O))C#N
InChI=1SC14H13N3O3Sc12211412(815)11(713(18)1614)943510(69)17(19)20h3611H27H21H3(H1618)
MFCD02241559
ZINC000006265696
ZINC000006265697

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Available files

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