Vitas-M small molecule compound
ethyl 3-(1,3-benzothiazol-2-yl)-7-{[(4-methoxyphenyl)carbonyl]oxy}-8-methyl-4-oxo-4H-chromene-2-carboxylate
Catalog ID
STK888397
SMILES CCOC(=O)c1oc2c(C)c(ccc2c(=O)c1c1nc2c(s1)cccc2)OC(=O)c1ccc(cc1)OC
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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 C28H21NO7S MW 515.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO7S/c1-4-34-28(32)25-22(26-29-19-7-5-6-8-21(19)37-26)23(30)18-13-14-20(15(2)24(18)36-25)35-27(31)16-9-11-17(33-3)12-10-16/h5-14H,4H2,1-3H3InChIKey
PKUVIQTXKIMXGO-UHFFFAOYSA-NSynonyms
610759-51-83BENZOTHIAZOL2YL2(ETHOXYCARBONYL)8METHYL4OXOCHROMEN7YL4METHOXYBENZOATE
610759518
CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)OC(=O)C3=CC=C(C=C3)OC)C)C4=NC5=CC=CC=C5S4
ethyl3(13benzothiazol2yl)7(((4methoxyphenyl)carbonyl)oxy)8methyl4oxo4Hchromene2carboxylate
ETHYL3(13BENZOTHIAZOL2YL)7(4METHOXYBENZOYL)OXY8METHYL4OXOCHROMENE2CARBOXYLATE
ethyl3(benzo(d)thiazol2yl)7((4methoxybenzoyl)oxy)8methyl4oxo4Hchromene2carboxylate
InChI=1SC28H21NO7Sc143428(32)2522(262919756821(19)3726)23(30)18131420(15(2)24(18)3625)3527(31)1691117(333)121016h514H4H213H3
MFCD03668760
ZINC000002197699
ZINC02197699
ZINC2197699
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