Vitas-M small molecule compound
(4E)-2-(1H-benzimidazol-2-yl)-4-{[(3,5-dimethoxyphenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK150015
SMILES COc1cc(N/C=C/2\C(=NN(C2=O)c2nc3c([nH]2)cccc3)C)cc(c1)OC
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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 C20H19N5O3 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O3/c1-12-16(11-21-13-8-14(27-2)10-15(9-13)28-3)19(26)25(24-12)20-22-17-6-4-5-7-18(17)23-20/h4-11,21H,1-3H3,(H,22,23)/b16-11+InChIKey
QLLUMYBDMKJSED-LFIBNONCSA-NSynonyms
(4E)2(1HBENZIMIDAZOL2YL)4(((35DIMETHOXYPHENYL)AMINO)METHYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(4E)2(1HBENZIMIDAZOL2YL)4((35DIMETHOXYANILINO)METHYLIDENE)5METHYLPYRAZOL3ONE
1BENZIMIDAZOL2YL4(((35DIMETHOXYPHENYL)AMINO)METHYLENE)3METHYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=CNC2=CC(=CC(=C2)OC)OC)C3=NC4=CC=CC=C4N3
COc1cc(NC=C2C(=NN(C2=O)c2nc3c((nH)2)cccc3)C)cc(c1)OC
InChI=1SC20H19N5O3c11216(112113814(272)1015(913)283)19(26)25(2412)202217645718(17)2320h41121H13H3(H2223)b1611+
MFCD04222003
ZINC000100430146
ZINC100430146
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