Vitas-M small molecule compound
methyl 4-[(2-{5-[(1,3-benzodioxol-5-ylcarbonyl)amino]-3-methyl-1H-pyrazol-1-yl}-1H-benzimidazol-1-yl)methyl]benzoate
Catalog ID
STK593205
SMILES COC(=O)c1ccc(cc1)Cn1c(nc2c1cccc2)n1nc(cc1NC(=O)c1ccc2c(c1)OCO2)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 C28H23N5O5 MW 509.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5O5/c1-17-13-25(30-26(34)20-11-12-23-24(14-20)38-16-37-23)33(31-17)28-29-21-5-3-4-6-22(21)32(28)15-18-7-9-19(10-8-18)27(35)36-2/h3-14H,15-16H2,1-2H3,(H,30,34)InChIKey
MKFUEMRBISPZRE-UHFFFAOYSA-NSynonyms
882218-26-0882218260
CC1=NN(C(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C4=NC5=CC=CC=C5N4CC6=CC=C(C=C6)C(=O)OC
InChI=1SC28H23N5O5c1171325(3026(34)2011122324(1420)38163723)33(3117)282921534622(21)32(28)15187919(10818)27(35)362h314H1516H212H3(H3034)
methyl4((2(5((13benzodioxol5ylcarbonyl)amino)3methyl1Hpyrazol1yl)1Hbenzimidazol1yl)methyl)benzoate
METHYL4((2(5(13BENZODIOXOLE5CARBONYLAMINO)3METHYLPYRAZOL1YL)BENZIMIDAZOL1YL)METHYL)BENZOATE
methyl4((2(5(benzo(d)(13)dioxole5carboxamido)3methyl1Hpyrazol1yl)1Hbenzo(d)imidazol1yl)methyl)benzoate
MFCD06336760
ZINC000009243739
ZINC09243739
ZINC9243739
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