Vitas-M small molecule compound
3-(3-methylphenyl)-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
STK887152
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(cc1)SC)c1cccc(c1)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 C22H21N3OS2 MW 407.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3OS2/c1-15-4-3-5-17(10-15)24-13-25-21(26)11-19(20(12-23)22(25)28-14-24)16-6-8-18(27-2)9-7-16/h3-10,19H,11,13-14H2,1-2H3InChIKey
KIJOECKRFMYNSC-UHFFFAOYSA-NSynonyms
3(3methylphenyl)8(4(methylsulfanyl)phenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
3(3methylphenyl)8(4methylsulfanylphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
CC1=CC(=CC=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC=C(C=C4)SC
InChI=1SC22H21N3OS2c11543517(1015)24132521(26)1119(20(1223)22(25)281424)166818(272)9716h31019H111314H212H3
MFCD10087962
ZINC000004923272
ZINC000004923273
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