Vitas-M small molecule compound

7-hydroxy-6-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-8-methyl-3-(4-methyl-1,3-thiazol-2-yl)-4H-chromen-4-one

Catalog ID
STK888142
SMILES OCCN1CCN(CC1)Cc1cc2c(c(c1O)C)occ(c2=O)c1scc(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 C21H25N3O4S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S/c1-13-12-29-21(22-13)17-11-28-20-14(2)18(26)15(9-16(20)19(17)27)10-24-5-3-23(4-6-24)7-8-25/h9,11-12,25-26H,3-8,10H2,1-2H3
InChIKey
SQJYZQMGTGFFDS-UHFFFAOYSA-N
Synonyms
384359-29-9
384359299
6((4(2HYDROXYETHYL)PIPERAZIN1IUM1YL)METHYL)8METHYL3(4METHYL13THIAZOL2YL)4OXOCHROMEN7OLATE
7hydroxy6((4(2hydroxyethyl)piperazin1yl)methyl)8methyl3(4methyl13thiazol2yl)4Hchromen4one
7HYDROXY6((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)8METHYL3(4METHYL13THIAZOL2YL)CHROMEN4ONE
7HYDROXY6((4(2HYDROXYETHYL)PIPERAZIN1YL)METHYL)8METHYL3(4METHYLTHIAZOL2YL)4HCHROMEN4ONE
7HYDROXY6((4(2HYDROXYETHYL)PIPERAZINYL)METHYL)8METHYL3(4METHYL(13THIAZOL2YL))CHROMEN4ONE
CC1=CSC(=N1)C2=COC3=C(C(=C(C=C3C2=O)CN4CCN(CC4)CCO)O)C
InChI=1SC21H25N3O4Sc113122921(2213)1711282014(2)18(26)15(916(20)19(17)27)10245323(4624)7825h911122526H3810H212H3
MFCD03146958
ZINC000020057493
ZINC20057493

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Available files

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