Vitas-M small molecule compound

ethyl 4-cyano-3-methyl-5-(pentanoylamino)thiophene-2-carboxylate

Catalog ID
STK163880
SMILES CCCCC(=O)Nc1sc(c(c1C#N)C)C(=O)OCC

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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 C14H18N2O3S MW 294.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N2O3S/c1-4-6-7-11(17)16-13-10(8-15)9(3)12(20-13)14(18)19-5-2/h4-7H2,1-3H3,(H,16,17)
InChIKey
XQINQOIWOGKJIP-UHFFFAOYSA-N
Synonyms

CCCCC(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N
ETHYL4CYANO3METHYL5(PENTANOYLAMINO)THIOPHENE2CARBOXYLATE
ETHYL4CYANO3METHYL5PENTANAMIDOTHIOPHENE2CARBOXYLATE
InChI=1SC14H18N2O3Sc146711(17)161310(815)9(3)12(2013)14(18)1952h47H213H3(H1617)
MFCD02965819
ZINC000001964986
ZINC01964986
ZINC1964986

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Available files

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