Vitas-M small molecule compound

2,8-dimethyl-4,5-dihydrofuro[3,2-e][1,3]benzothiazole-7-carboxylic acid

Catalog ID
STK604345
SMILES Cc1sc2c(n1)c1c(CC2)oc(c1C)C(=O)O

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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 C12H11NO3S MW 249.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11NO3S/c1-5-9-7(16-11(5)12(14)15)3-4-8-10(9)13-6(2)17-8/h3-4H2,1-2H3,(H,14,15)
InChIKey
IPIMDELNVOEPIN-UHFFFAOYSA-N
Synonyms
879916-91-3
28dimethyl45dihydrobenzofuro(45d)thiazole7carboxylicacid
28DIMETHYL45DIHYDROFURANO(32E)BENZOTHIAZOLE7CARBOXYLICACID
28dimethyl45dihydrofuro(32e)(13)benzothiazole7carboxylicacid
879916913
CC1=C(OC2=C1C3=C(CC2)SC(=N3)C)C(=O)O
InChI=1SC12H11NO3Sc1597(1611(5)12(14)15)34810(9)136(2)178h34H212H3(H1415)
MFCD06643916
ZINC000006757160
ZINC6757160

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.