Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Catalog ID
STL147895
SMILES OC1=Nc2c(C(SC1)c1ccc(cc1)OCc1ccccc1)c(=O)[nH]n2C1CCOC(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 C26H29N3O4S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4S/c1-26(2)14-19(12-13-33-26)29-24-22(25(31)28-29)23(34-16-21(30)27-24)18-8-10-20(11-9-18)32-15-17-6-4-3-5-7-17/h3-11,19,23H,12-16H2,1-2H3,(H,27,30)(H,28,31)InChIKey
VUBPKHDNRXYMMK-UHFFFAOYSA-NSynonyms
585561-75-74(4(benzyloxy)phenyl)1(22dimethyltetrahydro2Hpyran4yl)7hydroxy1246tetrahydro3Hpyrazolo(34e)(14)thiazepin3one
585561757
MFCD04082288
OC1=Nc2c(C(SC1)c1ccc(cc1)OCc1ccccc1)c(=O)(nH)n2C1CCOC(C1)(C)C
ZINC000002393591
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