Vitas-M small molecule compound
{1-[(4-bromo-2-chlorophenoxy)methyl]-1H-pyrazol-3-yl}(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)methanone
Catalog ID
STL396858
SMILES Brc1ccc(c(c1)Cl)OCn1ccc(n1)C(=O)N1CCN2C(C1)CCC2
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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 C18H20BrClN4O2 MW 439.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrClN4O2/c19-13-3-4-17(15(20)10-13)26-12-24-7-5-16(21-24)18(25)23-9-8-22-6-1-2-14(22)11-23/h3-5,7,10,14H,1-2,6,8-9,11-12H2InChIKey
OSKWKJWEWIOSDZ-UHFFFAOYSA-NSynonyms
1005659-41-5(1((4BROMO2CHLOROPHENOXY)METHYL)1HPYRAZOL3YL)(HEXAHYDROPYRROLO(12A)PYRAZIN2(1H)YL)METHANONE
1005659415
346788ahexahydro1Hpyrrolo(12a)pyrazin2yl(1((4bromo2chlorophenoxy)methyl)pyrazol3yl)methanone
C1CC2CN(CCN2C1)C(=O)C3=NN(C=C3)COC4=C(C=C(C=C4)Br)Cl
InChI=1SC18H20BrClN4O2c19133417(15(20)1013)2612247516(2124)18(25)23982261214(22)1123h3571014H126891112H2
MFCD04051289
ZINC000002798303
ZINC000002798304
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