Vitas-M small molecule compound
(4Z)-4-{[(2,5-dimethylphenyl)amino]methylidene}-5-methyl-2-(2,4,6-trichlorophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL359561
SMILES Cc1ccc(c(c1)N/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)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 C19H16Cl3N3O MW 408.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl3N3O/c1-10-4-5-11(2)17(6-10)23-9-14-12(3)24-25(19(14)26)18-15(21)7-13(20)8-16(18)22/h4-9,23H,1-3H3/b14-9-InChIKey
MFVMMKBFSQDHKO-ZROIWOOFSA-NSynonyms
(4Z)4(((25dimethylphenyl)amino)methylidene)5methyl2(246trichlorophenyl)24dihydro3Hpyrazol3one
(4Z)4((25dimethylanilino)methylidene)5methyl2(246trichlorophenyl)pyrazol3one
CC1=CC(=C(C=C1)C)NC=C2C(=NN(C2=O)C3=C(C=C(C=C3Cl)Cl)Cl)C
Cc1ccc(c(c1)NC=C1C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)C)C
InChI=1SC19H16Cl3N3Oc1104511(2)17(610)2391412(3)2425(19(14)26)1815(21)713(20)816(18)22h4923H13H3b149
MFCD28033754
ZINC000095471581
ZINC95471581
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