Vitas-M small molecule compound
1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-fluorophenyl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL410384
SMILES Fc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCOC(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 C19H22FN3O3S MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22FN3O3S/c1-19(2)9-13(7-8-26-19)23-17-15(18(25)22-23)16(27-10-14(24)21-17)11-3-5-12(20)6-4-11/h3-6,13,16H,7-10H2,1-2H3,(H,21,24)(H,22,25)InChIKey
QQWPWGRDPDXRSP-UHFFFAOYSA-NSynonyms
1(22dimethyltetrahydro2Hpyran4yl)4(4fluorophenyl)7hydroxy1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
Fc1ccc(cc1)C1SCC(=Nc2c1c(=O)(nH)n2C1CCOC(C1)(C)C)O
MFCD30706177
ZINC000009360488
ZINC000009360498
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