Vitas-M small molecule compound
(4E)-2-(1H-benzimidazol-2-yl)-4-(1-ethoxyethylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK206718
SMILES CCO/C(=C/1\C(=NN(C1=O)c1nc2c([nH]1)cccc2)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 C15H16N4O2 MW 284.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2/c1-4-21-10(3)13-9(2)18-19(14(13)20)15-16-11-7-5-6-8-12(11)17-15/h5-8H,4H2,1-3H3,(H,16,17)/b13-10+InChIKey
CSMKFQXCAANAEG-JLHYYAGUSA-NSynonyms
(4E)2(1Hbenzimidazol2yl)4(1ethoxyethylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(1HBENZIMIDAZOL2YL)4(1ETHOXYETHYLIDENE)5METHYLPYRAZOL3ONE
(Z)1(1Hbenzo(d)imidazol2yl)4(1ethoxyethylidene)3methyl1Hpyrazol5(4H)one
CCOC(=C1C(=NN(C1=O)c1nc2c((nH)1)cccc2)C)C
CCOC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3N2)C)C
InChI=1SC15H16N4O2c142110(3)139(2)1819(14(13)20)151611756812(11)1715h58H4H213H3(H1617)b1310+
MFCD03759869
ZINC000000118096
ZINC00118096
ZINC118096
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