Vitas-M small molecule compound
3-(3-chlorophenyl)-8-(2,5-dimethoxyphenyl)-6-oxo-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK847524
SMILES COc1ccc(c(c1)C1CC(=O)N2C(=C1C#N)SCN(C2)c1cccc(c1)Cl)OC
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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 C22H20ClN3O3S MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN3O3S/c1-28-16-6-7-20(29-2)18(9-16)17-10-21(27)26-12-25(13-30-22(26)19(17)11-24)15-5-3-4-14(23)8-15/h3-9,17H,10,12-13H2,1-2H3InChIKey
FTJIXFYFNGABAO-UHFFFAOYSA-NSynonyms
896094-82-93(3chlorophenyl)8(25dimethoxyphenyl)6oxo234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chlorophenyl)8(25dimethoxyphenyl)6oxo2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
3(3chlorophenyl)8(25dimethoxyphenyl)6oxo3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896094829
COC1=CC(=C(C=C1)OC)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC(=CC=C4)Cl
InChI=1SC22H20ClN3O3Sc128166720(292)18(916)171021(27)261225(133022(26)19(17)1124)1553414(23)815h3917H101213H212H3
MFCD06601614
ZINC000002229234
ZINC000002229237
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