Vitas-M small molecule compound
2,6-diamino-4-(3-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile
Catalog ID
STK750363
SMILES N#CC1=C(N)SC(=C(C1c1cccc(c1)[N+](=O)[O-])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 C13H9N5O2S MW 299.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N5O2S/c14-5-9-11(10(6-15)13(17)21-12(9)16)7-2-1-3-8(4-7)18(19)20/h1-4,11H,16-17H2InChIKey
KQIBBFRZHGAINV-UHFFFAOYSA-NSynonyms
294873-16-826DIAMINO4(3NITROPHENYL)4HTHIIN35DICARBONITRILE
26diamino4(3nitrophenyl)4Hthiopyran35dicarbonitrile
294873168
C1=CC(=CC(=C1)(N+)(=O)(O))C2C(=C(SC(=C2C#N)N)N)C#N
InChI=1SC13H9N5O2Sc145911(10(615)13(17)2112(9)16)72138(47)18(19)20h1411H1617H2
MFCD00228041
N#CC1=C(N)SC(=C(C1c1cccc(c1)(N+)(=O)(O))C#N)N
ZINC000002271327
ZINC02271327
ZINC2271327
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