Vitas-M small molecule compound

8-(4-fluorophenyl)-6-oxo-3-(2-phenylethyl)-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile

Catalog ID
STK826933
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)F)CCc1ccccc1

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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 C22H20FN3OS MW 393.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3OS/c23-18-8-6-17(7-9-18)19-12-21(27)26-14-25(15-28-22(26)20(19)13-24)11-10-16-4-2-1-3-5-16/h1-9,19H,10-12,14-15H2
InChIKey
UIBHHTWZCPBRQK-UHFFFAOYSA-N
Synonyms

8(4fluorophenyl)6oxo3(2phenylethyl)2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(4fluorophenyl)6oxo3(2phenylethyl)3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
C1C(C(=C2N(C1=O)CN(CS2)CCC3=CC=CC=C3)C#N)C4=CC=C(C=C4)F
InChI=1SC22H20FN3OSc23188617(7918)191221(27)261425(152822(26)20(19)1324)1110164213516h1919H10121415H2
MFCD10086943
ZINC000020348063
ZINC000020348064

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.