Vitas-M small molecule compound

dimethyl 5-{[(1-ethylpiperidin-4-yl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK467035
SMILES CCN1CCC(CC1)NC(=S)Nc1sc(c(c1C(=O)OC)C)C(=O)OC

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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 C17H25N3O4S2 MW 399.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O4S2/c1-5-20-8-6-11(7-9-20)18-17(25)19-14-12(15(21)23-3)10(2)13(26-14)16(22)24-4/h11H,5-9H2,1-4H3,(H2,18,19,25)
InChIKey
FLWJVXIMHCJFJN-UHFFFAOYSA-N
Synonyms

CCN1CCC(CC1)NC(=S)NC2=C(C(=C(S2)C(=O)OC)C)C(=O)OC
dimethyl5(((1ethylpiperidin4yl)carbamothioyl)amino)3methylthiophene24dicarboxylate
dimethyl5((1ethylpiperidin4yl)carbamothioylamino)3methylthiophene24dicarboxylate
InChI=1SC17H25N3O4S2c15208611(7920)1817(25)191412(15(21)233)10(2)13(2614)16(22)244h11H59H214H3(H2181925)
MFCD06157548
ZINC000017081755
ZINC17081755

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Available files

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