Vitas-M small molecule compound

3'-cyano-5'-(ethoxycarbonyl)-6'-methyl-1',4'-dihydro-3,4'-bipyridine-2'-thiolate

Catalog ID
STL058902
SMILES CCOC(=O)C1=C(C)NC(=C(C1c1cccnc1)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 C15H14N3O2S MW 300.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O2S/c1-3-20-15(19)12-9(2)18-14(21)11(7-16)13(12)10-5-4-6-17-8-10/h4-6,8,13,18,21H,3H2,1-2H3/p-1
InChIKey
QHKDCMBIMYGDJG-UHFFFAOYSA-M
Synonyms

3cyano5(ethoxycarbonyl)6methyl14dihydro34bipyridine2thiolate
C1COCC(NH2+)1CCOC(=O)C1=C(C)NC(=C(C1c1cccnc1)C#N)(S)
CCOC(=O)C1=C(C)NC(=C(C1c1cccnc1)C#N)(S)
morpholin4ium3cyano5(ethoxycarbonyl)6methyl14dihydro(34bipyridine)2thiolate
ZINC000020813257
ZINC000020813260

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.