Vitas-M small molecule compound
8-[4-(benzyloxy)phenyl]-3-(4-methylphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK827361
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)OCc1ccccc1)c1ccc(cc1)C
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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/c1-20-7-11-23(12-8-20)30-18-31-27(32)15-25(26(16-29)28(31)34-19-30)22-9-13-24(14-10-22)33-17-21-5-3-2-4-6-21/h2-14,25H,15,17-19H2,1H3InChIKey
QXZTUGHCNUAOAK-UHFFFAOYSA-NSynonyms
3(4methylphenyl)6oxo8(4phenylmethoxyphenyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4(benzyloxy)phenyl)3(4methylphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=CC=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5
InChI=1SC28H25N3O2Sc12071123(12820)30183127(32)1525(26(1629)28(31)341930)2291324(141022)3317215324621h21425H151719H21H3
MFCD10087683
ZINC000012251054
ZINC000012251055
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