Vitas-M small molecule compound
3-benzyl-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
STK887019
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccc(cc1)Cl)Cc1ccccc1
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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 C28H24ClN3O2S MW 502.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN3O2S/c29-23-10-6-21(7-11-23)17-34-24-12-8-22(9-13-24)25-14-27(33)32-18-31(16-20-4-2-1-3-5-20)19-35-28(32)26(25)15-30/h1-13,25H,14,16-19H2InChIKey
HUBXFECDLAYNPT-UHFFFAOYSA-NSynonyms
3benzyl8(4((4chlorobenzyl)oxy)phenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
3benzyl8(4((4chlorophenyl)methoxy)phenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
C1C(C(=C2N(C1=O)CN(CS2)CC3=CC=CC=C3)C#N)C4=CC=C(C=C4)OCC5=CC=C(C=C5)Cl
InChI=1SC28H24ClN3O2Sc292310621(71123)17342412822(91324)251427(33)321831(16204213520)193528(32)26(25)1530h11325H141619H2
MFCD10087753
ZINC000020348304
ZINC000020348305
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