Vitas-M small molecule compound

methyl 2-(butanoylamino)-4-methyl-5-phenylthiophene-3-carboxylate

Catalog ID
STK541540
SMILES CCCC(=O)Nc1sc(c(c1C(=O)OC)C)c1ccccc1

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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 C17H19NO3S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO3S/c1-4-8-13(19)18-16-14(17(20)21-3)11(2)15(22-16)12-9-6-5-7-10-12/h5-7,9-10H,4,8H2,1-3H3,(H,18,19)
InChIKey
ABAAARGZLMTOHM-UHFFFAOYSA-N
Synonyms
500105-75-9
500105759
CCCC(=O)NC1=C(C(=C(S1)C2=CC=CC=C2)C)C(=O)OC
InChI=1SC17H19NO3Sc14813(19)181614(17(20)213)11(2)15(2216)1296571012h57910H48H213H3(H1819)
methyl2(butanoylamino)4methyl5phenylthiophene3carboxylate
methyl2butyramido4methyl5phenylthiophene3carboxylate
MFCD03304163
ZINC000001282618
ZINC01282618
ZINC1282618

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Available files

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