Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 2-methylbenzoate
Catalog ID
STK539685
SMILES O=C(c1ccccc1C)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 C26H16F3NO4S MW 495.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16F3NO4S/c1-13-7-3-4-8-15(13)25(32)33-18-12-11-16-21(31)20(23(26(27,28)29)34-22(16)14(18)2)24-30-17-9-5-6-10-19(17)35-24/h3-12H,1-2H3InChIKey
JCVSMVYCGJMHQE-UHFFFAOYSA-NSynonyms
384801-38-1(3(13BENZOTHIAZOL2YL)8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)2METHYLBENZOATE
3(13benzothiazol2yl)8methyl4oxo2(trifluoromethyl)4Hchromen7yl2methylbenzoate
3(benzo(d)thiazol2yl)8methyl4oxo2(trifluoromethyl)4Hchromen7yl2methylbenzoate
384801381
3BENZOTHIAZOL2YL8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YL2METHYLBENZOATE
CC1=CC=CC=C1C(=O)OC2=C(C3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)C4=NC5=CC=CC=C5S4)C
InChI=1SC26H16F3NO4Sc113734815(13)25(32)331812111621(31)20(23(26(2728)29)3422(16)14(18)2)2430179561019(17)3524h312H12H3
MFCD03284277
ZINC000002317792
ZINC02317792
ZINC2317792
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