Vitas-M small molecule compound
3-(4-bromophenyl)-8-{4-[(4-chlorobenzyl)oxy]phenyl}-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK887018
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccc(cc1)Cl)c1ccc(cc1)Br
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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 C27H21BrClN3O2S MW 566.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21BrClN3O2S/c28-20-5-9-22(10-6-20)31-16-32-26(33)13-24(25(14-30)27(32)35-17-31)19-3-11-23(12-4-19)34-15-18-1-7-21(29)8-2-18/h1-12,24H,13,15-17H2InChIKey
XRFSQZFGGVGFPL-UHFFFAOYSA-NSynonyms
3(4bromophenyl)8(4((4chlorobenzyl)oxy)phenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
3(4bromophenyl)8(4((4chlorophenyl)methoxy)phenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
C1C(C(=C2N(C1=O)CN(CS2)C3=CC=C(C=C3)Br)C#N)C4=CC=C(C=C4)OCC5=CC=C(C=C5)Cl
InChI=1SC27H21BrClN3O2Sc28205922(10620)31163226(33)1324(25(1430)27(32)351731)1931123(12419)3415181721(29)8218h11224H131517H2
MFCD10574662
ZINC000098048473
ZINC000098048474
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