Vitas-M small molecule compound
(4Z)-2-(1H-benzimidazol-2-yl)-4-({[2-(1H-imidazol-4-yl)ethyl]amino}methylidene)-5-(4-methoxyphenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK207417
SMILES COc1ccc(cc1)C1=NN(C(=O)/C/1=C\NCCc1c[nH]cn1)c1nc2c([nH]1)cccc2
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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 C23H21N7O2 MW 427.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N7O2/c1-32-17-8-6-15(7-9-17)21-18(13-24-11-10-16-12-25-14-26-16)22(31)30(29-21)23-27-19-4-2-3-5-20(19)28-23/h2-9,12-14,24H,10-11H2,1H3,(H,25,26)(H,27,28)/b18-13-InChIKey
ZIQTXIHWTUXICC-AQTBWJFISA-NSynonyms
(4Z)2(1Hbenzimidazol2yl)4(((2(1Himidazol4yl)ethyl)amino)methylidene)5(4methoxyphenyl)24dihydro3Hpyrazol3one
(4Z)2(1Hbenzimidazol2yl)4((2(1Himidazol5yl)ethylamino)methylidene)5(4methoxyphenyl)pyrazol3one
1BENZIMIDAZOL2YL4(((2IMIDAZOL4YLETHYL)AMINO)METHYLENE)3(4METHOXYPHENYL)12DIAZOLIN5ONE
COC1=CC=C(C=C1)C2=NN(C(=O)C2=CNCCC3=CN=CN3)C4=NC5=CC=CC=C5N4
COc1ccc(cc1)C1=NN(C(=O)C1=CNCCc1c(nH)cn1)c1nc2c((nH)1)cccc2
InChI=1SC23H21N7O2c132178615(7917)2118(13241110161225142616)22(31)30(2921)232719423520(19)2823h29121424H1011H21H3(H2526)(H2728)b1813
MFCD06754393
ZINC000009972296
ZINC9972296
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