Vitas-M small molecule compound

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

Catalog ID
STK887151
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)SC)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 C23H23N3OS2 MW 421.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3OS2/c1-3-16-6-4-5-7-21(16)25-14-26-22(27)12-19(20(13-24)23(26)29-15-25)17-8-10-18(28-2)11-9-17/h4-11,19H,3,12,14-15H2,1-2H3
InChIKey
VLYAERMZZYTMAW-UHFFFAOYSA-N
Synonyms

3(2ethylphenyl)8(4(methylsulfanyl)phenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
3(2ethylphenyl)8(4methylsulfanylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
CCC1=CC=CC=C1N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)SC
InChI=1SC23H23N3OS2c1316645721(16)25142622(27)1219(20(1324)23(26)291525)1781018(282)11917h41119H3121415H212H3
MFCD10087961
ZINC000004923257
ZINC000004923260

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Available files

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