Vitas-M small molecule compound
(4Z)-4-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-1-(3,4-dimethylphenyl)pyrazolidine-3,5-dione
Catalog ID
STL432657
SMILES O=C1NN(C(=O)/C/1=C\c1ccc2c(c1)n(C)c(=O)n2C)c1ccc(c(c1)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 C21H20N4O3 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3/c1-12-5-7-15(9-13(12)2)25-20(27)16(19(26)22-25)10-14-6-8-17-18(11-14)24(4)21(28)23(17)3/h5-11H,1-4H3,(H,22,26)/b16-10-InChIKey
MBRKDNRTQBIRBK-YBEGLDIGSA-NSynonyms
(4Z)4((13dimethyl2oxo23dihydro1Hbenzimidazol5yl)methylidene)1(34dimethylphenyl)pyrazolidine35dione
(4Z)4((13DIMETHYL2OXOBENZIMIDAZOL5YL)METHYLIDENE)1(34DIMETHYLPHENYL)PYRAZOLIDINE35DIONE
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3)N(C(=O)N4C)C)C(=O)N2)C
InChI=1SC21H20N4O3c1125715(913(12)2)2520(27)16(19(26)2225)1014681718(1114)24(4)21(28)23(17)3h511H14H3(H2226)b1610
MFCD05028761
O=C1NN(C(=O)C1=Cc1ccc2c(c1)n(C)c(=O)n2C)c1ccc(c(c1)C)C
ZINC000004498102
ZINC04498102
ZINC4498102
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