Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-methoxyphenyl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Catalog ID
STL150170
SMILES COc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2C1CCOC(C1)(C)C)O
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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 C21H27N3O3S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S/c1-13-18-19(14-5-7-16(26-4)8-6-14)28-12-17(25)22-20(18)24(23-13)15-9-10-27-21(2,3)11-15/h5-8,15,19H,9-12H2,1-4H3,(H,22,25)InChIKey
WFSCFDJYVYIFDV-UHFFFAOYSA-NSynonyms
673453-37-71(22dimethyltetrahydro2Hpyran4yl)4(4methoxyphenyl)3methyl46dihydro1Hpyrazolo(34e)(14)thiazepin7ol
673453377
MFCD04079047
ZINC000013123344
ZINC000013123347
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