Vitas-M small molecule compound

diethyl 5-{[2-(3-chlorophenoxy)propanoyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK418148
SMILES CCOC(=O)c1c(NC(=O)C(Oc2cccc(c2)Cl)C)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 C20H22ClNO6S MW 439.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO6S/c1-5-26-19(24)15-11(3)16(20(25)27-6-2)29-18(15)22-17(23)12(4)28-14-9-7-8-13(21)10-14/h7-10,12H,5-6H2,1-4H3,(H,22,23)
InChIKey
XGTRSIQXUPAWSV-UHFFFAOYSA-N
Synonyms
438615-87-3
438615873
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)OC2=CC(=CC=C2)Cl
DIETHYL5(((2R)2(3CHLOROPHENOXY)PROPANOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIETHYL5(((2S)2(3CHLOROPHENOXY)PROPANOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
diethyl5((2(3chlorophenoxy)propanoyl)amino)3methylthiophene24dicarboxylate
DIETHYL5(2(3CHLOROPHENOXY)PROPANOYLAMINO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC20H22ClNO6Sc152619(24)1511(3)16(20(25)2762)2918(15)2217(23)12(4)281497813(21)1014h71012H56H214H3(H2223)
MFCD02242697
ZINC000000997541
ZINC000000997542

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Available files

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