Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl ethanedioate
Catalog ID
STL513615
SMILES CCOC(=O)C(=O)Oc1cc2oc(C(=O)OCC)c(c(=O)c2cc1CC)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 C25H21NO8S MW 495.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO8S/c1-4-13-11-14-17(12-16(13)34-25(30)24(29)32-6-3)33-21(23(28)31-5-2)19(20(14)27)22-26-15-9-7-8-10-18(15)35-22/h7-12H,4-6H2,1-3H3InChIKey
MPWXLVUWHLBJTR-UHFFFAOYSA-NSynonyms
384364-53-81593877
2~(O)(3(13benzothiazol2yl)2ethoxycarbonyl6ethyl4oxochromen7yl)1~(O)ethyloxalate
2O(3(13BENZOTHIAZOL2YL)2ETHOXYCARBONYL6ETHYL4OXOCHROMEN7YL)1OETHYLOXALATE
3(13benzothiazol2yl)2(ethoxycarbonyl)6ethyl4oxo4Hchromen7ylethylethanedioate
3(BENZO(D)THIAZOL2YL)2(ETHOXYCARBONYL)6ETHYL4OXO4HCHROMEN7YLETHYLOXALATE
384364538
3BENZOTHIAZOL2YL2(ETHOXYCARBONYL)6ETHYL4OXOCHROMEN7YLETHYLETHANE12DIOATE
InChI=1SC25H21NO8Sc1413111417(1216(13)3425(30)24(29)3263)3321(23(28)3152)19(20(14)27)2226159781018(15)3522h712H46H213H3
MFCD03266291
ZINC000001810925
ZINC1810925
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