Vitas-M small molecule compound

diethyl 5-{[(1-benzofuran-2-ylcarbonyl)carbamothioyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK017440
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cc3c(o2)cccc3)sc(c1C)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 C21H20N2O6S2 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6S2/c1-4-27-19(25)15-11(3)16(20(26)28-5-2)31-18(15)23-21(30)22-17(24)14-10-12-8-6-7-9-13(12)29-14/h6-10H,4-5H2,1-3H3,(H2,22,23,24,30)
InChIKey
PHKQFVWUAOWJRE-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2
CCOC(=O)c1c(NC(=S)NC(=O)c2cc3c(o2)cccc3)sc(c1C)C(=O)OCC
DIETHYL5(((1BENZOFURAN2YLCARBONYL)CARBAMOTHIOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIETHYL5(1BENZOFURAN2CARBONYLCARBAMOTHIOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC21H20N2O6S2c142719(25)1511(3)16(20(26)2852)3118(15)2321(30)2217(24)141012867913(12)2914h610H45H213H3(H222232430)
MFCD03227174
STK017440
ZINC000002996569
ZINC02996569
ZINC2996569

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Available files

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