Vitas-M small molecule compound
5-bromo-N'-[(E)-{2,5-dimethyl-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-1H-pyrrol-3-yl}methylidene]-1-benzofuran-2-carbohydrazide
Catalog ID
STK198170
SMILES Brc1ccc2c(c1)cc(o2)C(=O)N/N=C/c1cc(n(c1C)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)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 C32H32BrN3O2 MW 570.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32BrN3O2/c1-19-9-25(18-34-35-31(37)30-14-24-13-27(33)5-8-29(24)38-30)20(2)36(19)28-6-3-26(4-7-28)32-15-21-10-22(16-32)12-23(11-21)17-32/h3-9,13-14,18,21-23H,10-12,15-17H2,1-2H3,(H,35,37)/b34-18+InChIKey
LIDHVJABHSYMMT-FABQOPTDSA-NSynonyms
5bromoN((E)(25dimethyl1(4(tricyclo(3311~37~)dec1yl)phenyl)1Hpyrrol3yl)methylidene)1benzofuran2carbohydrazide
Brc1ccc2c(c1)cc(o2)C(=O)NN=Cc1cc(n(c1C)c1ccc(cc1)C12CC3CC(C2)CC(C1)C3)C
CC1=CC(=C(N1C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)C)C=NNC(=O)C6=CC7=C(O6)C=CC(=C7)Br
InChI=1SC32H32BrN3O2c119925(18343531(37)3014241327(33)5829(24)3830)20(2)36(19)286326(4728)3215211022(1632)1223(1121)1732h391314182123H10121517H212H3(H3537)b3418+
MFCD02904927
N((E)(1(4(1adamantyl)phenyl)25dimethylpyrrol3yl)methylideneamino)5bromo1benzofuran2carboxamide
ZINC000097960886
ZINC08437029
ZINC8437029
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