Vitas-M small molecule compound
8-(2,5-dimethoxyphenyl)-6-oxo-3-phenyl-3,4,7,8-tetrahydro-2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile
Catalog ID
STK849053
SMILES COc1ccc(c(c1)C1CC(=O)N2C(=C1C#N)SCN(C2)c1ccccc1)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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c1-27-16-8-9-20(28-2)18(10-16)17-11-21(26)25-13-24(15-6-4-3-5-7-15)14-29-22(25)19(17)12-23/h3-10,17H,11,13-14H2,1-2H3InChIKey
WULNTJHOWRFMJX-UHFFFAOYSA-NSynonyms
896092-05-08(25dimethoxyphenyl)6oxo3phenyl234678hexahydropyrido(21b)(135)thiadiazine9carbonitrile
8(25dimethoxyphenyl)6oxo3phenyl2478tetrahydropyrido(21b)(135)thiadiazine9carbonitrile
8(25dimethoxyphenyl)6oxo3phenyl3478tetrahydro2H6Hpyrido(21b)(135)thiadiazine9carbonitrile
896092050
COC1=CC(=C(C=C1)OC)C2CC(=O)N3CN(CSC3=C2C#N)C4=CC=CC=C4
InChI=1SC22H21N3O3Sc127168920(282)18(1016)171121(26)251324(156435715)142922(25)19(17)1223h31017H111314H212H3
MFCD06600579
ZINC000002225583
ZINC000002225585
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