Vitas-M small molecule compound
(4E)-2-(3,4-dimethylphenyl)-5-methyl-4-({[4-(morpholin-4-ylcarbonyl)phenyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295886
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(cc1)C(=O)N1CCOCC1)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 C24H26N4O3 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3/c1-16-4-9-21(14-17(16)2)28-24(30)22(18(3)26-28)15-25-20-7-5-19(6-8-20)23(29)27-10-12-31-13-11-27/h4-9,14-15,25H,10-13H2,1-3H3/b22-15+InChIKey
QDQLCXMRRYWGON-PXLXIMEGSA-NSynonyms
(4E)2(34dimethylphenyl)5methyl4(((4(morpholin4ylcarbonyl)phenyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(34dimethylphenyl)5methyl4((4(morpholine4carbonyl)anilino)methylidene)pyrazol3one
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)C(=O)N4CCOCC4)C(=N2)C)C
CC1=NN(C(=O)C1=CNc1ccc(cc1)C(=O)N1CCOCC1)c1ccc(c(c1)C)C
InChI=1SC24H26N4O3c1164921(1417(16)2)2824(30)22(18(3)2628)1525207519(6820)23(29)27101231131127h49141525H1013H213H3b2215+
MFCD28033206
ZINC000005518564
ZINC5518564
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