Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-8-[(2,6-dimethylpiperidinium-1-yl)methyl]-6-ethyl-4-oxo-4H-chromen-7-olate
Catalog ID
STK632040
SMILES CCc1cc2c(c(c1[O-])C[NH+]1C(C)CCCC1C)occ(c2=O)c1nc2c(s1)cccc2
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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 C26H28N2O3S MW 448.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3S/c1-4-17-12-18-24(30)20(26-27-21-10-5-6-11-22(21)32-26)14-31-25(18)19(23(17)29)13-28-15(2)8-7-9-16(28)3/h5-6,10-12,14-16,29H,4,7-9,13H2,1-3H3InChIKey
FIQZJFNKDJRREJ-UHFFFAOYSA-NSynonyms
637747-25-23(13BENZOTHIAZOL2YL)8((26DIMETHYLPIPERIDIN1YL)METHYL)6ETHYL7HYDROXYCHROMEN4ONE
3(13benzothiazol2yl)8((26dimethylpiperidinium1yl)methyl)6ethyl4oxo4Hchromen7olate
3(BENZO(D)THIAZOL2YL)8((26DIMETHYLPIPERIDIN1YL)METHYL)6ETHYL7HYDROXY4HCHROMEN4ONE
3BENZOTHIAZOL2YL8((26DIMETHYLPIPERIDYL)METHYL)6ETHYL7HYDROXYCHROMEN4ONE
CCc1cc2c(c(c1(O))C(NH+)1C(C)CCCC1C)occ(c2=O)c1nc2c(s1)cccc2
MFCD03669060
ZINC000002666247
ZINC000002666249
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