Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl morpholine-4-carboxylate

Catalog ID
STK841815
SMILES O=C(N1CCOCC1)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

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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 C23H17F3N2O5S MW 490.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17F3N2O5S/c1-12-15(32-22(30)28-8-10-31-11-9-28)7-6-13-18(29)17(20(23(24,25)26)33-19(12)13)21-27-14-4-2-3-5-16(14)34-21/h2-7H,8-11H2,1H3
InChIKey
DMPMCCZYHRBOEU-UHFFFAOYSA-N
Synonyms
433328-66-6
(3(13BENZOTHIAZOL2YL)8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)MORPHOLINE4CARBOXYLATE
3(13benzothiazol2yl)8methyl4oxo2(trifluoromethyl)4Hchromen7ylmorpholine4carboxylate
3(benzo(d)thiazol2yl)8methyl4oxo2(trifluoromethyl)4Hchromen7ylmorpholine4carboxylate
433328666
CC1=C(C=CC2=C1OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F)OC(=O)N5CCOCC5
InChI=1SC23H17F3N2O5Sc11215(3222(30)288103111928)761318(29)17(20(23(2425)26)3319(12)13)212714423516(14)3421h27H811H21H3
MFCD03146397
ZINC000001096600
ZINC01096600
ZINC1096600

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Available files

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