Vitas-M small molecule compound

diethyl 5-({[3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropyl]carbonyl}amino)-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK809653
SMILES CCOC(=O)c1c(NC(=O)C2C(C2(C)C)C=C(Cl)Cl)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 C19H23Cl2NO5S MW 448.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23Cl2NO5S/c1-6-26-17(24)12-9(3)14(18(25)27-7-2)28-16(12)22-15(23)13-10(8-11(20)21)19(13,4)5/h8,10,13H,6-7H2,1-5H3,(H,22,23)
InChIKey
KWZQKZOPUGFUBB-UHFFFAOYSA-N
Synonyms
297146-87-3
297146873
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2C(C2(C)C)C=C(Cl)Cl
DIETHYL5((((1R3R)3(22DICHLOROETHENYL)22DIMETHYLCYCLOPROPYL)CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIETHYL5((((1S3S)3(22DICHLOROETHENYL)22DIMETHYLCYCLOPROPYL)CARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
diethyl5(((3(22dichloroethenyl)22dimethylcyclopropyl)carbonyl)amino)3methylthiophene24dicarboxylate
DIETHYL5(((3(22DICHLOROVINYL)22DIMETHYLCYCLOPROPYL)CARBONYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
DIETHYL5((3(22DICHLOROETHENYL)22DIMETHYLCYCLOPROPANECARBONYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIETHYL5(3(22DICHLOROVINYL)22DIMETHYLCYCLOPROPANECARBOXAMIDO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC19H23Cl2NO5Sc162617(24)129(3)14(18(25)2772)2816(12)2215(23)1310(811(20)21)19(134)5h81013H67H215H3(H2223)
MFCD00790319
ZINC000001009445
ZINC000001009448

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Available files

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