Vitas-M small molecule compound

methyl 2-(butanoylamino)-5-carbamoyl-4-methylthiophene-3-carboxylate

Catalog ID
STK448946
SMILES CCCC(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N

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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 C12H16N2O4S MW 284.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N2O4S/c1-4-5-7(15)14-11-8(12(17)18-3)6(2)9(19-11)10(13)16/h4-5H2,1-3H3,(H2,13,16)(H,14,15)
InChIKey
NMVRJZCLKNQTER-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=C(C(=C(S1)C(=O)N)C)C(=O)OC
InChI=1SC12H16N2O4Sc1457(15)14118(12(17)183)6(2)9(1911)10(13)16h45H213H3(H21316)(H1415)
methyl2(butanoylamino)5carbamoyl4methylthiophene3carboxylate
MFCD06091099
ZINC000017009245
ZINC17009245

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Available files

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