Vitas-M small molecule compound

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

Catalog ID
STK886081
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OC)c1ccc(cc1)Br

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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 C22H20BrN3O3S MW 486.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O3S/c1-28-19-8-3-14(9-20(19)29-2)17-10-21(27)26-12-25(13-30-22(26)18(17)11-24)16-6-4-15(23)5-7-16/h3-9,17H,10,12-13H2,1-2H3
InChIKey
NGYLGPYTMVCDLS-UHFFFAOYSA-N
Synonyms

3(4bromophenyl)8(34dimethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(4bromophenyl)8(34dimethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
COC1=C(C=C(C=C1)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=C(C=C4)Br)OC
InChI=1SC22H20BrN3O3Sc128198314(920(19)292)171021(27)261225(133022(26)18(17)1124)166415(23)5716h3917H101213H212H3
MFCD14762372
ZINC000009693116
ZINC000009693117

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Available files

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