Vitas-M small molecule compound
(4Z)-2-(3,4-dimethylphenyl)-4-{[(2-iodophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL359381
SMILES CC1=NN(C(=O)/C/1=C\Nc1ccccc1I)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 C19H18IN3O MW 431.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18IN3O/c1-12-8-9-15(10-13(12)2)23-19(24)16(14(3)22-23)11-21-18-7-5-4-6-17(18)20/h4-11,21H,1-3H3/b16-11-InChIKey
MXAPXFKMUOVWDZ-WJDWOHSUSA-NSynonyms
(4Z)2(34dimethylphenyl)4(((2iodophenyl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4Z)2(34dimethylphenyl)4((2iodoanilino)methylidene)5methylpyrazol3one
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC=CC=C3I)C(=N2)C)C
CC1=NN(C(=O)C1=CNc1ccccc1I)c1ccc(c(c1)C)C
InChI=1SC19H18IN3Oc1128915(1013(12)2)2319(24)16(14(3)2223)112118754617(18)20h41121H13H3b1611
MFCD00746642
ZINC000022000483
ZINC22000483
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