Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl acetate
Catalog ID
STK840271
SMILES CC(=O)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 C20H12F3NO4S MW 419.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12F3NO4S/c1-9-13(27-10(2)25)8-7-11-16(26)15(18(20(21,22)23)28-17(9)11)19-24-12-5-3-4-6-14(12)29-19/h3-8H,1-2H3InChIKey
MKJYVWLIVCGHKC-UHFFFAOYSA-NSynonyms
384374-42-9(3(13BENZOTHIAZOL2YL)8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YL)ACETATE
3(13benzothiazol2yl)8methyl4oxo2(trifluoromethyl)4Hchromen7ylacetate
3(BENZO(D)THIAZOL2YL)8METHYL4OXO2(TRIFLUOROMETHYL)4HCHROMEN7YLACETATE
384374429
3BENZOTHIAZOL2YL8METHYL4OXO2(TRIFLUOROMETHYL)CHROMEN7YLACETATE
CC1=C(C=CC2=C1OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C(F)(F)F)OC(=O)C
InChI=1SC20H12F3NO4Sc1913(2710(2)25)871116(26)15(18(20(2122)23)2817(9)11)192412534614(12)2919h38H12H3
MFCD03146914
ZINC000001156177
ZINC01156177
ZINC1156177
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