Vitas-M small molecule compound
7-{2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-2-oxoethoxy}-5-hydroxy-2,2-dimethyl-2,3-dihydro-4H-chromen-4-one
Catalog ID
STL237555
SMILES O=C(N1CCC(CC1)c1nc2c(s1)cccc2)COc1cc(O)c2c(c1)OC(CC2=O)(C)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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-25(2)13-19(29)23-18(28)11-16(12-20(23)32-25)31-14-22(30)27-9-7-15(8-10-27)24-26-17-5-3-4-6-21(17)33-24/h3-6,11-12,15,28H,7-10,13-14H2,1-2H3InChIKey
BQUWRALGAUHFIA-UHFFFAOYSA-NSynonyms
1013753-20-21013753202
7(2(4(13benzothiazol2yl)piperidin1yl)2oxoethoxy)5hydroxy22dimethyl23dihydro4Hchromen4one
7(2(4(13benzothiazol2yl)piperidin1yl)2oxoethoxy)5hydroxy22dimethyl3Hchromen4one
7(2(4(benzo(d)thiazol2yl)piperidin1yl)2oxoethoxy)5hydroxy22dimethylchroman4one
CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)O)C
InChI=1SC25H26N2O5Sc125(2)1319(29)2318(28)1116(1220(23)3225)311422(30)279715(81027)242617534621(17)3324h3611121528H7101314H212H3
MFCD09847760
ZINC000008990716
ZINC08990716
ZINC8990716
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