Vitas-M small molecule compound

2,6-diamino-4-(2,6-dichlorophenyl)-4H-thiopyran-3,5-dicarbonitrile

Catalog ID
STK832685
SMILES N#CC1=C(N)SC(=C(C1c1c(Cl)cccc1Cl)C#N)N

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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 C13H8Cl2N4S MW 323.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8Cl2N4S/c14-8-2-1-3-9(15)11(8)10-6(4-16)12(18)20-13(19)7(10)5-17/h1-3,10H,18-19H2
InChIKey
YBNSEMWBQMVUAQ-UHFFFAOYSA-N
Synonyms
333759-84-5
26diamino4(26dichlorophenyl)4Hthiopyran35dicarbonitrile
333759845
C1=CC(=C(C(=C1)Cl)C2C(=C(SC(=C2C#N)N)N)C#N)Cl
InChI=1SC13H8Cl2N4Sc1482139(15)11(8)106(416)12(18)2013(19)7(10)517h1310H1819H2
MFCD00486961
ZINC000000198108
ZINC00198108
ZINC198108

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Available files

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