Vitas-M small molecule compound
7-hydroxy-1-(tetrahydro-2H-pyran-4-yl)-4-(2,3,4-trifluorophenyl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL411144
SMILES OC1=Nc2n([nH]c(=O)c2C(SC1)c1ccc(c(c1F)F)F)C1CCOCC1
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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 C17H16F3N3O3S MW 399.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F3N3O3S/c18-10-2-1-9(13(19)14(10)20)15-12-16(21-11(24)7-27-15)23(22-17(12)25)8-3-5-26-6-4-8/h1-2,8,15H,3-7H2,(H,21,24)(H,22,25)InChIKey
SXWPLPDHHSKCTJ-UHFFFAOYSA-NSynonyms
1574411-48-51(oxan4yl)4(234trifluorophenyl)48dihydro2Hpyrazolo(34e)(14)thiazepine37dione
1574411485
7hydroxy1(tetrahydro2Hpyran4yl)4(234trifluorophenyl)1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
C1COCCC1N2C3=C(C(SCC(=O)N3)C4=C(C(=C(C=C4)F)F)F)C(=O)N2
InChI=1SC17H16F3N3O3Sc1810219(13(19)14(10)20)151216(2111(24)72715)23(2217(12)25)83526648h12815H37H2(H2124)(H2225)
MFCD30706559
OC1=Nc2n((nH)c(=O)c2C(SC1)c1ccc(c(c1F)F)F)C1CCOCC1
ZINC000096117505
ZINC000096117506
Check stock
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