Vitas-M small molecule compound
3-(3-chloro-4-methylphenyl)-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
STK887079
SMILES N#CC1=C2SCN(CN2C(=O)CC1c1ccc(c(c1)OC)OC)c1ccc(c(c1)Cl)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 C23H22ClN3O3S MW 455.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3S/c1-14-4-6-16(9-19(14)24)26-12-27-22(28)10-17(18(11-25)23(27)31-13-26)15-5-7-20(29-2)21(8-15)30-3/h4-9,17H,10,12-13H2,1-3H3InChIKey
PCNJDSLBOCZXGV-UHFFFAOYSA-NSynonyms
3(3chloro4methylphenyl)8(34dimethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chloro4methylphenyl)8(34dimethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
CC1=C(C=C(C=C1)N2CN3C(=O)CC(C(=C3SC2)C#N)C4=CC(=C(C=C4)OC)OC)Cl
InChI=1SC23H22ClN3O3Sc1144616(919(14)24)26122722(28)1017(18(1125)23(27)311326)155720(292)21(815)303h4917H101213H213H3
MFCD10087840
ZINC000006578065
ZINC000006578066
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