Vitas-M small molecule compound

3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl thiophene-2-carboxylate

Catalog ID
STK844990
SMILES COc1cccc(c1)Oc1c(=O)c2ccc(cc2oc1C(F)(F)F)OC(=O)c1cccs1

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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 C22H13F3O6S MW 462.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13F3O6S/c1-28-12-4-2-5-13(10-12)29-19-18(26)15-8-7-14(30-21(27)17-6-3-9-32-17)11-16(15)31-20(19)22(23,24)25/h2-11H,1H3
InChIKey
CRDJJPRQZMIYQW-UHFFFAOYSA-N
Synonyms
637749-64-5
(3(3METHOXYPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)THIOPHENE2CARBOXYLATE
3(3methoxyphenoxy)4oxo2(trifluoromethyl)4Hchromen7ylthiophene2carboxylate
3(3METHOXYPHENOXY)4OXO2(TRIFLUOROMETHYL)CHROMEN7YLTHIOPHENE2CARBOXYLATE
637749645
COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=CS4)C(F)(F)F
InChI=1SC22H13F3O6Sc1281242513(1012)291918(26)158714(3021(27)176393217)1116(15)3120(19)22(2324)25h211H1H3
MFCD04008943
ZINC000001448030
ZINC01448030
ZINC1448030

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Available files

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