Vitas-M small molecule compound
3,5-dibromo-N'-{(E)-[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-4-methoxybenzohydrazide
Catalog ID
STK387760
SMILES COc1c(Br)cc(cc1Br)C(=O)N/N=C/c1cc(n(c1C)c1ccc(cc1)C(C)(C)C)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 C25H27Br2N3O2 MW 561.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27Br2N3O2/c1-15-11-18(16(2)30(15)20-9-7-19(8-10-20)25(3,4)5)14-28-29-24(31)17-12-21(26)23(32-6)22(27)13-17/h7-14H,1-6H3,(H,29,31)/b28-14+InChIKey
NESUWPIKJGLUMX-CCVNUDIWSA-NSynonyms
35DIBROMON((E)(1(4TERTBUTYLPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)4METHOXYBENZOHYDRAZIDE
35dibromoN((E)(1(4tertbutylphenyl)25dimethylpyrrol3yl)methylideneamino)4methoxybenzamide
CC1=CC(=C(N1C2=CC=C(C=C2)C(C)(C)C)C)C=NNC(=O)C3=CC(=C(C(=C3)Br)OC)Br
COc1c(Br)cc(cc1Br)C(=O)NN=Cc1cc(n(c1C)c1ccc(cc1)C(C)(C)C)C
InChI=1SC25H27Br2N3O2c1151118(16(2)30(15)209719(81020)25(34)5)14282924(31)171221(26)23(326)22(27)1317h714H16H3(H2931)b2814+
MFCD02067140
N((1E)2(1(4(TERTBUTYL)PHENYL)25DIMETHYLPYRROL3YL)1AZAVINYL)(35DIBROMO4METHOXYPHENYL)CARBOXAMIDE
ZINC000004062594
ZINC100286003
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