Vitas-M small molecule compound

ethyl 2-(butanoylamino)-5-(cyclohexylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK403216
SMILES CCCC(=O)Nc1sc(c(c1C(=O)OCC)C)C(=O)NC1CCCCC1

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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 C19H28N2O4S MW 380.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2O4S/c1-4-9-14(22)21-18-15(19(24)25-5-2)12(3)16(26-18)17(23)20-13-10-7-6-8-11-13/h13H,4-11H2,1-3H3,(H,20,23)(H,21,22)
InChIKey
PRHBENAFTFMCBU-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=C(C(=C(S1)C(=O)NC2CCCCC2)C)C(=O)OCC
ethyl2(butanoylamino)5(cyclohexylcarbamoyl)4methylthiophene3carboxylate
ETHYL2(BUTANOYLAMINO)5(NCYCLOHEXYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC19H28N2O4Sc14914(22)211815(19(24)2552)12(3)16(2618)17(23)2013107681113h13H411H213H3(H2023)(H2122)
MFCD03312443
ZINC000001165356
ZINC01165356
ZINC1165356

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Available files

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