Vitas-M small molecule compound
2-hydroxy-4-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoic acid
Catalog ID
STK079259
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc(c(c2)O)C(=O)O)/C1=O)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 C21H17N5O5S MW 451.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O5S/c1-11-18(24-23-13-5-8-15(20(29)30)17(27)9-13)19(28)26(25-11)21-22-16(10-32-21)12-3-6-14(31-2)7-4-12/h3-10,23,27H,1-2H3,(H,29,30)/b24-18-InChIKey
IKXHSISXTRRTBS-MOHJPFBDSA-NSynonyms
314759-58-52HYDROXY4((2Z)2(1(4(4METHOXYPHENYL)13THIAZOL2YL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
2HYDROXY4((2Z)2(1(4(4METHOXYPHENYL)13THIAZOL2YL)3METHYL5OXOPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
314759585
CC1=NN(C(=O)C1=NNC2=CC(=C(C=C2)C(=O)O)O)C3=NC(=CS3)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc(c(c2)O)C(=O)O)C1=O)C
InChI=1SC21H17N5O5Sc11118(2423135815(20(29)30)17(27)913)19(28)26(2511)212216(103221)123614(312)7412h3102327H12H3(H2930)b2418
MFCD02026060
STK079259
ZINC000012403902
ZINC100341589
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