Vitas-M small molecule compound
(4E)-4-{[(3,5-dichlorophenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK580689
SMILES Clc1cc(N/C=C/2\C(=NN(C2=O)c2ccccc2)C)cc(c1)Cl
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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 C17H13Cl2N3O MW 346.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13Cl2N3O/c1-11-16(10-20-14-8-12(18)7-13(19)9-14)17(23)22(21-11)15-5-3-2-4-6-15/h2-10,20H,1H3/b16-10+InChIKey
AQWWJKBVOMLHII-MHWRWJLKSA-NSynonyms
(4E)4(((35dichlorophenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazol3one
(4E)4((35DICHLOROANILINO)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(E)4(((35dichlorophenyl)amino)methylene)3methyl1phenyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=CNC2=CC(=CC(=C2)Cl)Cl)C3=CC=CC=C3
Clc1cc(NC=C2C(=NN(C2=O)c2ccccc2)C)cc(c1)Cl
InChI=1SC17H13Cl2N3Oc11116(102014812(18)713(19)914)17(23)22(2111)155324615h21020H1H3b1610+
MFCD00127232
ZINC000100148767
ZINC100148767
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