Vitas-M small molecule compound
2-({(E)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1H-isoindole-1,3(2H)-dione
Catalog ID
STL383139
SMILES CC1=NN(C(=O)/C/1=C/NN1C(=O)c2c(C1=O)cccc2)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 C21H18N4O3 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3/c1-12-8-9-15(10-13(12)2)24-21(28)18(14(3)23-24)11-22-25-19(26)16-6-4-5-7-17(16)20(25)27/h4-11,22H,1-3H3/b18-11+InChIKey
VIUIFUQMHXFQTC-WOJGMQOQSA-NSynonyms
2(((E)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)1Hisoindole13(2H)dione
2(((E)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)isoindole13dione
CC1=C(C=C(C=C1)N2C(=O)C(=CNN3C(=O)C4=CC=CC=C4C3=O)C(=N2)C)C
CC1=NN(C(=O)C1=CNN1C(=O)c2c(C1=O)cccc2)c1ccc(c(c1)C)C
InChI=1SC21H18N4O3c1128915(1013(12)2)2421(28)18(14(3)2324)11222519(26)16645717(16)20(25)27h41122H13H3b1811+
MFCD28952507
ZINC000098087119
ZINC98087119
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