Vitas-M small molecule compound
8-[3-(benzyloxy)phenyl]-3-(2-ethylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK886954
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cccc(c1)OCc1ccccc1)c1ccccc1CC
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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 C29H27N3O2S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O2S/c1-2-22-11-6-7-14-27(22)31-19-32-28(33)16-25(26(17-30)29(32)35-20-31)23-12-8-13-24(15-23)34-18-21-9-4-3-5-10-21/h3-15,25H,2,16,18-20H2,1H3InChIKey
HOISBAONZAXOGY-UHFFFAOYSA-NSynonyms
3(2ethylphenyl)6oxo8(3phenylmethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(3(benzyloxy)phenyl)3(2ethylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CCC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC29H27N3O2Sc122211671427(22)31193228(33)1625(26(1730)29(32)352031)231281324(1523)34182194351021h31525H2161820H21H3
MFCD10087644
ZINC000012251024
ZINC000012251025
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