Vitas-M small molecule compound
(4E)-2-(3,4-dimethylphenyl)-5-methyl-4-({[4-(piperidin-1-ylsulfonyl)phenyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK670497
SMILES CC1=NN(C(=O)/C/1=C/Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)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 C24H28N4O3S MW 452.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O3S/c1-17-7-10-21(15-18(17)2)28-24(29)23(19(3)26-28)16-25-20-8-11-22(12-9-20)32(30,31)27-13-5-4-6-14-27/h7-12,15-16,25H,4-6,13-14H2,1-3H3/b23-16+InChIKey
FXZGXLIDYOHAJA-XQNSMLJCSA-NSynonyms
(4E)2(34dimethylphenyl)5methyl4(((4(piperidin1ylsulfonyl)phenyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(34DIMETHYLPHENYL)5METHYL4((4PIPERIDIN1YLSULFONYLANILINO)METHYLIDENE)PYRAZOL3ONE
1(34DIMETHYLPHENYL)3METHYL4(((4(PIPERIDYLSULFONYL)PHENYL)AMINO)METHYLENE)12DIAZOLIN5ONE
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C(=N2)C)C
CC1=NN(C(=O)C1=CNc1ccc(cc1)S(=O)(=O)N1CCCCC1)c1ccc(c(c1)C)C
InChI=1SC24H28N4O3Sc11771021(1518(17)2)2824(29)23(19(3)2628)16252081122(12920)32(3031)27135461427h712151625H461314H213H3b2316+
MFCD00697333
ZINC000006198399
ZINC06198399
ZINC6198399
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