Vitas-M small molecule compound
{5-[4-(difluoromethoxy)phenyl]-1H-pyrazol-3-yl}{4-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]piperazin-1-yl}methanone
Catalog ID
STL398501
SMILES CCn1nc(c(c1)CN1CCN(CC1)C(=O)c1n[nH]c(c1)c1ccc(cc1)OC(F)F)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 C22H26F2N6O2 MW 444.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26F2N6O2/c1-3-30-14-17(15(2)27-30)13-28-8-10-29(11-9-28)21(31)20-12-19(25-26-20)16-4-6-18(7-5-16)32-22(23)24/h4-7,12,14,22H,3,8-11,13H2,1-2H3,(H,25,26)InChIKey
WOTOIHJCOAOGRY-UHFFFAOYSA-NSynonyms
1092785-45-9(3(4(difluoromethoxy)phenyl)1Hpyrazol5yl)(4((1ethyl3methylpyrazol4yl)methyl)piperazin1yl)methanone
(5(4(DIFLUOROMETHOXY)PHENYL)1HPYRAZOL3YL)(4((1ETHYL3METHYL1HPYRAZOL4YL)METHYL)PIPERAZIN1YL)METHANONE
1092785459
CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)OC(F)F
CCn1nc(c(c1)CN1CCN(CC1)C(=O)c1n(nH)c(c1)c1ccc(cc1)OC(F)F)C
InChI=1SC22H26F2N6O2c13301417(15(2)2730)132881029(11928)21(31)201219(252620)164618(7516)3222(23)24h47121422H381113H212H3(H2526)
MFCD04139173
ZINC000019640492
ZINC19640492
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