Vitas-M small molecule compound
N-{4-[(1E)-1-{2-[(4-bromo-1,3-dimethyl-1H-pyrazol-5-yl)carbonyl]hydrazinylidene}ethyl]phenyl}-4-methoxybenzamide
Catalog ID
STK452852
SMILES COc1ccc(cc1)C(=O)Nc1ccc(cc1)/C(=N/NC(=O)c1n(C)nc(c1Br)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 C22H22BrN5O3 MW 484.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22BrN5O3/c1-13(25-26-22(30)20-19(23)14(2)27-28(20)3)15-5-9-17(10-6-15)24-21(29)16-7-11-18(31-4)12-8-16/h5-12H,1-4H3,(H,24,29)(H,26,30)/b25-13+InChIKey
QEOKUCHZTLHRTG-DHRITJCHSA-NSynonyms
4BROMON((E)1(4((4METHOXYBENZOYL)AMINO)PHENYL)ETHYLIDENEAMINO)25DIMETHYLPYRAZOLE3CARBOXAMIDE
CC1=NN(C(=C1Br)C(=O)NN=C(C)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C
COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(=NNC(=O)c1n(C)nc(c1Br)C)C
InChI=1SC22H22BrN5O3c113(252622(30)2019(23)14(2)2728(20)3)155917(10615)2421(29)1671118(314)12816h512H14H3(H2429)(H2630)b2513+
MFCD02607818
N(4((1E)1(2((4bromo13dimethyl1Hpyrazol5yl)carbonyl)hydrazinylidene)ethyl)phenyl)4methoxybenzamide
N(4((1E)2((4BROMO13DIMETHYLPYRAZOL5YL)CARBONYLAMINO)1METHYL2AZAVINYL)PHENYL)(4METHOXYPHENYL)CARBOXAMIDE
ZINC000020294160
ZINC33856574
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