Vitas-M small molecule compound

ethyl 5-phenyl-2-{[(tetrahydrofuran-2-ylmethyl)carbamothioyl]amino}thiophene-3-carboxylate

Catalog ID
STK438650
SMILES CCOC(=O)c1cc(sc1NC(=S)NCC1CCCO1)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 C19H22N2O3S2 MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S2/c1-2-23-18(22)15-11-16(13-7-4-3-5-8-13)26-17(15)21-19(25)20-12-14-9-6-10-24-14/h3-5,7-8,11,14H,2,6,9-10,12H2,1H3,(H2,20,21,25)
InChIKey
BKYBIIGBBYUNKA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NCC3CCCO3
ETHYL2((((OXOLAN2YLMETHYL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2(OXOLAN2YLMETHYLCARBAMOTHIOYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ethyl5phenyl2(((tetrahydrofuran2ylmethyl)carbamothioyl)amino)thiophene3carboxylate
InChI=1SC19H22N2O3S2c122318(22)151116(137435813)2617(15)2119(25)20121496102414h35781114H2691012H21H3(H2202125)
MFCD03945611
ZINC000005980026
ZINC000005980027

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Available files

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