Vitas-M small molecule compound

methyl 4-cyano-5-{[(2,4-dimethylphenoxy)acetyl]amino}-3-methylthiophene-2-carboxylate

Catalog ID
STK520335
SMILES COC(=O)c1sc(c(c1C)C#N)NC(=O)COc1ccc(cc1C)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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-10-5-6-14(11(2)7-10)24-9-15(21)20-17-13(8-19)12(3)16(25-17)18(22)23-4/h5-7H,9H2,1-4H3,(H,20,21)
InChIKey
WWUHWHWTNCQLJK-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)OCC(=O)NC2=C(C(=C(S2)C(=O)OC)C)C#N)C
InChI=1SC18H18N2O4Sc1105614(11(2)710)24915(21)201713(819)12(3)16(2517)18(22)234h57H9H214H3(H2021)
METHYL4CYANO5(((24DIMETHYLPHENOXY)ACETYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
methyl4cyano5(((24dimethylphenoxy)acetyl)amino)3methylthiophene2carboxylate
methyl4cyano5((2(24dimethylphenoxy)acetyl)amino)3methylthiophene2carboxylate
MFCD03241096
ZINC000016285017
ZINC16285017

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Available files

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