Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(2-ethoxyphenyl)-3-methyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Catalog ID
STK780441
SMILES CCOc1ccccc1C1SCC(=O)Nc2c1c(C)nn2C1CCOC(C1)(C)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 C22H29N3O3S MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O3S/c1-5-27-17-9-7-6-8-16(17)20-19-14(2)24-25(21(19)23-18(26)13-29-20)15-10-11-28-22(3,4)12-15/h6-9,15,20H,5,10-13H2,1-4H3,(H,23,26)InChIKey
LDFOQKIACFDQPR-UHFFFAOYSA-NSynonyms
586996-11-41(22dimethyltetrahydro2Hpyran4yl)4(2ethoxyphenyl)3methyl48dihydro1Hpyrazolo(34e)(14)thiazepin7(6H)one
1(22dimethyltetrahydro2Hpyran4yl)4(2ethoxyphenyl)3methyl68dihydro1Hpyrazolo(34e)(14)thiazepin7(4H)one
MFCD04031269
ZINC000006554688
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