Vitas-M small molecule compound

methyl (2Z)-2-cyano-3-(5-methyl-4-nitrothiophen-2-yl)prop-2-enoate

Catalog ID
STK400359
SMILES N#C/C(=C/c1sc(c(c1)[N+](=O)[O-])C)/C(=O)OC

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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 C10H8N2O4S MW 252.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8N2O4S/c1-6-9(12(14)15)4-8(17-6)3-7(5-11)10(13)16-2/h3-4H,1-2H3/b7-3-
InChIKey
RGAQXWOEDBKDOZ-CLTKARDFSA-N
Synonyms

CC1=C(C=C(S1)C=C(C#N)C(=O)OC)(N+)(=O)(O)
InChI=1SC10H8N2O4Sc169(12(14)15)48(176)37(511)10(13)162h34H12H3b73
METHYL(2Z)2CYANO3(5METHYL4NITRO(2THIENYL))PROP2ENOATE
methyl(2Z)2cyano3(5methyl4nitrothiophen2yl)prop2enoate
METHYL(Z)2CYANO3(5METHYL4NITROTHIOPHEN2YL)PROP2ENOATE
MFCD01118684
N#CC(=Cc1sc(c(c1)(N+)(=O)(O))C)C(=O)OC
ZINC000000135575
ZINC00135575
ZINC135575

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Available files

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