Vitas-M small molecule compound

4-(ethoxycarbonyl)phenyl 3-chloro-1-benzothiophene-2-carboxylate

Catalog ID
STL064788
SMILES CCOC(=O)c1ccc(cc1)OC(=O)c1sc2c(c1Cl)cccc2

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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 C18H13ClO4S MW 360.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClO4S/c1-2-22-17(20)11-7-9-12(10-8-11)23-18(21)16-15(19)13-5-3-4-6-14(13)24-16/h3-10H,2H2,1H3
InChIKey
JTBUNFLJCODHFI-UHFFFAOYSA-N
Synonyms

(4ETHOXYCARBONYLPHENYL)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4(ethoxycarbonyl)phenyl3chloro1benzothiophene2carboxylate
CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3S2)Cl
InChI=1SC18H13ClO4Sc122217(20)117912(10811)2318(21)1615(19)13534614(13)2416h310H2H21H3
MFCD02211373
ZINC000001192105
ZINC01192105
ZINC1192105

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Available files

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