Vitas-M small molecule compound
5-(dimethylamino)-6-({(Z)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK234900
SMILES Fc1ccc(cc1)N1N=C(/C(=C/Nc2cc3c(cc2N(C)C)n(c(=O)n3C)C)/C1=O)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 C22H23FN6O2 MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN6O2/c1-13-16(21(30)29(25-13)15-8-6-14(23)7-9-15)12-24-17-10-19-20(11-18(17)26(2)3)28(5)22(31)27(19)4/h6-12,24H,1-5H3/b16-12-InChIKey
FBOPVYTXIOZRKB-VBKFSLOCSA-NSynonyms
5(dimethylamino)6(((Z)(1(4fluorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)13dimethyl13dihydro2Hbenzimidazol2one
5(dimethylamino)6(((Z)(1(4fluorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)13dimethylbenzimidazol2one
CC1=NN(C(=O)C1=CNC2=C(C=C3C(=C2)N(C(=O)N3C)C)N(C)C)C4=CC=C(C=C4)F
Fc1ccc(cc1)N1N=C(C(=CNc2cc3c(cc2N(C)C)n(c(=O)n3C)C)C1=O)C
InChI=1SC22H23FN6O2c11316(21(30)29(2513)158614(23)7915)122417101920(1118(17)26(2)3)28(5)22(31)27(19)4h61224H15H3b1612
MFCD08681211
ZINC000009189879
ZINC09189879
ZINC9189879
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