Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-6-ethyl-4-oxo-4H-chromen-7-yl 3,4-dimethoxybenzoate

Catalog ID
STK845615
SMILES CCc1cc2c(cc1OC(=O)c1ccc(c(c1)OC)OC)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 C27H21NO6S MW 487.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO6S/c1-4-15-11-17-22(13-21(15)34-27(30)16-9-10-20(31-2)23(12-16)32-3)33-14-18(25(17)29)26-28-19-7-5-6-8-24(19)35-26/h5-14H,4H2,1-3H3
InChIKey
UJRRIWRDUNUBFT-UHFFFAOYSA-N
Synonyms
578732-41-9
(3(13BENZOTHIAZOL2YL)6ETHYL4OXOCHROMEN7YL)34DIMETHOXYBENZOATE
3(13benzothiazol2yl)6ethyl4oxo4Hchromen7yl34dimethoxybenzoate
3(BENZO(D)THIAZOL2YL)6ETHYL4OXO4HCHROMEN7YL34DIMETHOXYBENZOATE
3BENZOTHIAZOL2YL6ETHYL4OXOCHROMEN7YL34DIMETHOXYBENZOATE
578732419
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4S3)OC(=O)C5=CC(=C(C=C5)OC)OC
InChI=1SC27H21NO6Sc1415111722(1321(15)3427(30)1691020(312)23(1216)323)331418(25(17)29)262819756824(19)3526h514H4H213H3
MFCD04031442
ZINC000002394443
ZINC02394443
ZINC2394443

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Available files

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