Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-2-(ethoxycarbonyl)-4-oxo-4H-chromen-7-yl morpholine-4-carboxylate

Catalog ID
STK844207
SMILES CCOC(=O)c1oc2cc(ccc2c(=O)c1c1nc2c(s1)cccc2)OC(=O)N1CCOCC1

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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 C24H20N2O7S MW 480.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O7S/c1-2-31-23(28)21-19(22-25-16-5-3-4-6-18(16)34-22)20(27)15-8-7-14(13-17(15)33-21)32-24(29)26-9-11-30-12-10-26/h3-8,13H,2,9-12H2,1H3
InChIKey
XNNOLLQGCBVFBO-UHFFFAOYSA-N
Synonyms
799770-29-9
(3(13BENZOTHIAZOL2YL)2ETHOXYCARBONYL4OXOCHROMEN7YL)MORPHOLINE4CARBOXYLATE
3(13benzothiazol2yl)2(ethoxycarbonyl)4oxo4Hchromen7ylmorpholine4carboxylate
3(BENZO(D)THIAZOL2YL)2(ETHOXYCARBONYL)4OXO4HCHROMEN7YLMORPHOLINE4CARBOXYLATE
3BENZOTHIAZOL2YL2(ETHOXYCARBONYL)4OXOCHROMEN7YLMORPHOLINE4CARBOXYLATE
799770299
CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)N3CCOCC3)C4=NC5=CC=CC=C5S4
InChI=1SC24H20N2O7Sc123123(28)2119(222516534618(16)3422)20(27)158714(1317(15)3321)3224(29)2691130121026h3813H2912H21H3
MFCD03671426
ZINC000002203904
ZINC02203904
ZINC2203904

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Available files

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