Vitas-M small molecule compound
methyl 4-({(Z)-[1-(2,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Catalog ID
STK957431
SMILES COC(=O)c1ccc(cc1)N/C=C\1/C(=NN(C1=O)c1ccc(cc1C)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 C21H21N3O3 MW 363.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3/c1-13-5-10-19(14(2)11-13)24-20(25)18(15(3)23-24)12-22-17-8-6-16(7-9-17)21(26)27-4/h5-12,22H,1-4H3/b18-12-InChIKey
LMFVMOPMEOESHK-PDGQHHTCSA-NSynonyms
352681-65-3352681653
CC1=CC(=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)C(=O)OC)C(=N2)C)C
COC(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1ccc(cc1C)C)C
InChI=1SC21H21N3O3c11351019(14(2)1113)2420(25)18(15(3)2324)1222178616(7917)21(26)274h51222H14H3b1812
METHYL4(((1(24DIMETHYLPHENYL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
methyl4(((Z)(1(24dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
METHYL4(((Z)(1(24DIMETHYLPHENYL)3METHYL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
MFCD01178513
ZINC000005578408
ZINC05578408
ZINC5578408
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