Vitas-M small molecule compound
8-[3-(benzyloxy)phenyl]-3-(2-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827335
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1cccc(c1)OCc1ccccc1)c1ccccc1C
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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 C28H25N3O2S MW 467.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O2S/c1-20-8-5-6-13-26(20)30-18-31-27(32)15-24(25(16-29)28(31)34-19-30)22-11-7-12-23(14-22)33-17-21-9-3-2-4-10-21/h2-14,24H,15,17-19H2,1H3InChIKey
BNNWPHDTNDHHBX-UHFFFAOYSA-NSynonyms
3(2methylphenyl)6oxo8(3phenylmethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(3(benzyloxy)phenyl)3(2methylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=CC=C4)OCC5=CC=CC=C5
InChI=1SC28H25N3O2Sc1208561326(20)30183127(32)1524(25(1629)28(31)341930)221171223(1422)33172193241021h21424H151719H21H3
MFCD10087636
ZINC000012251012
ZINC000012251013
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