Vitas-M small molecule compound
7-[2-(azepan-1-yl)-2-oxoethoxy]-3-(2-methyl-1,3-thiazol-4-yl)-2H-chromen-2-one
Catalog ID
STL237156
SMILES O=C(N1CCCCCC1)COc1ccc2c(c1)oc(=O)c(c2)c1csc(n1)C
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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 C21H22N2O4S MW 398.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S/c1-14-22-18(13-28-14)17-10-15-6-7-16(11-19(15)27-21(17)25)26-12-20(24)23-8-4-2-3-5-9-23/h6-7,10-11,13H,2-5,8-9,12H2,1H3InChIKey
RFZIUYZXWZNGMN-UHFFFAOYSA-NSynonyms
1081118-27-51081118275
7(2(azepan1yl)2oxoethoxy)3(2methyl13thiazol4yl)2Hchromen2one
7(2(azepan1yl)2oxoethoxy)3(2methyl13thiazol4yl)chromen2one
7(2(azepan1yl)2oxoethoxy)3(2methylthiazol4yl)2Hchromen2one
CC1=NC(=CS1)C2=CC3=C(C=C(C=C3)OCC(=O)N4CCCCCC4)OC2=O
InChI=1SC21H22N2O4Sc1142218(132814)1710156716(1119(15)2721(17)25)261220(24)2384235923h67101113H258912H21H3
MFCD12209350
ZINC000020738681
ZINC20738681
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