Vitas-M small molecule compound

methyl 2-{[(2E)-2-cyano-3-(5-methylfuran-2-yl)prop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK867435
SMILES N#C/C(=C\c1ccc(o1)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C

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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 C17H16N2O4S MW 344.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4S/c1-9-5-6-13(23-9)7-12(8-18)15(20)19-16-14(17(21)22-4)10(2)11(3)24-16/h5-7H,1-4H3,(H,19,20)/b12-7+
InChIKey
SXMJSFWONHGXDL-KPKJPENVSA-N
Synonyms
468749-11-3
(E)methyl2(2cyano3(5methylfuran2yl)acrylamido)45dimethylthiophene3carboxylate
468749113
CC1=CC=C(O1)C=C(C#N)C(=O)NC2=C(C(=C(S2)C)C)C(=O)OC
InChI=1SC17H16N2O4Sc195613(239)712(818)15(20)191614(17(21)224)10(2)11(3)2416h57H14H3(H1920)b127+
methyl2(((2E)2cyano3(5methylfuran2yl)prop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2(((E)2CYANO3(5METHYLFURAN2YL)PROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((2E)2CYANO3(5METHYL(2FURYL))PROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02370958
N#CC(=Cc1ccc(o1)C)C(=O)Nc1sc(c(c1C(=O)OC)C)C
ZINC000002377657
ZINC02377657
ZINC2377657

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Available files

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