Vitas-M small molecule compound
8-(5-bromo-2-methoxyphenyl)-3-(2-methoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK850509
SMILES COc1ccccc1N1CSC2=C(C#N)C(CC(=O)N2C1)c1cc(Br)ccc1OC
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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 C22H20BrN3O3S MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O3S/c1-28-19-8-7-14(23)9-16(19)15-10-21(27)26-12-25(13-30-22(26)17(15)11-24)18-5-3-4-6-20(18)29-2/h3-9,15H,10,12-13H2,1-2H3InChIKey
DOSOYTJSPMWMFY-UHFFFAOYSA-NSynonyms
896090-02-18(5bromo2methoxyphenyl)3(2methoxyphenyl)6oxo234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(2methoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(5bromo2methoxyphenyl)3(2methoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896090021
COC1=C(C=C(C=C1)Br)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=CC=C4OC
InChI=1SC22H20BrN3O3Sc128198714(23)916(19)151021(27)261225(133022(26)17(15)1124)18534620(18)292h3915H101213H212H3
MFCD06606136
ZINC000002327341
ZINC000002327343
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