Vitas-M small molecule compound
(6-bromo-1,3-benzodioxol-5-yl)methyl 4-(1H-pyrazol-1-yl)benzoate
Catalog ID
STK781995
SMILES O=C(c1ccc(cc1)n1cccn1)OCc1cc2OCOc2cc1Br
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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 C18H13BrN2O4 MW 401.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13BrN2O4/c19-15-9-17-16(24-11-25-17)8-13(15)10-23-18(22)12-2-4-14(5-3-12)21-7-1-6-20-21/h1-9H,10-11H2InChIKey
DYLJZIOIKJHPSK-UHFFFAOYSA-NSynonyms
(6bromo13benzodioxol5yl)methyl4(1Hpyrazol1yl)benzoate
(6BROMO13BENZODIOXOL5YL)METHYL4PYRAZOL1YLBENZOATE
C1OC2=C(O1)C=C(C(=C2)COC(=O)C3=CC=C(C=C3)N4C=CC=N4)Br
InChI=1SC18H13BrN2O4c191591716(24112517)813(15)102318(22)122414(5312)217162021h19H1011H2
MFCD06016293
ZINC000004727267
ZINC04727267
ZINC4727267
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