Vitas-M small molecule compound
(4Z)-2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-4-[2-(2,4-dimethylphenyl)hydrazinylidene]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK017439
SMILES CCCCc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc(cc2C)C)/C1=O)c1ccc(cc1)[N+](=O)[O-]
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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 C30H28N6O3S MW 552.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N6O3S/c1-4-5-6-21-8-10-22(11-9-21)26-18-40-30(31-26)35-29(37)28(33-32-25-16-7-19(2)17-20(25)3)27(34-35)23-12-14-24(15-13-23)36(38)39/h7-18,32H,4-6H2,1-3H3/b33-28-InChIKey
UZTYWQSVHWKPGH-MDVFONAFSA-NSynonyms
(4Z)2(4(4BUTYLPHENYL)13THIAZOL2YL)4((24DIMETHYLPHENYL)HYDRAZINYLIDENE)5(4NITROPHENYL)PYRAZOL3ONE
(4Z)2(4(4BUTYLPHENYL)13THIAZOL2YL)4(2(24DIMETHYLPHENYL)HYDRAZINYLIDENE)5(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
CCCCC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=C(C=C(C=C4)C)C)C(=N3)C5=CC=C(C=C5)(N+)(=O)(O)
CCCCc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc(cc2C)C)C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC30H28N6O3Sc14562181022(11921)26184030(3126)3529(37)28(33322516719(2)1720(25)3)27(3435)23121424(151323)36(38)39h71832H46H213H3b3328
MFCD03033072
STK017439
ZINC000101398769
ZINC101398772
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.