Vitas-M small molecule compound

2-[(2E)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]naphthalene-1-sulfonic acid

Catalog ID
STK083933
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N\Nc2ccc3c(c2S(=O)(=O)O)cccc3)/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 C24H19N5O5S2 MW 521.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N5O5S2/c1-14-21(27-26-19-12-9-15-5-3-4-6-18(15)22(19)36(31,32)33)23(30)29(28-14)24-25-20(13-35-24)16-7-10-17(34-2)11-8-16/h3-13,26H,1-2H3,(H,31,32,33)/b27-21+
InChIKey
BPZRAKOXQGWRDV-SZXQPVLSSA-N
Synonyms

2((2E)2(1(4(4METHOXYPHENYL)13THIAZOL2YL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)NAPHTHALENE1SULFONICACID
2((2E)2(1(4(4methoxyphenyl)13thiazol2yl)3methyl5oxopyrazol4ylidene)hydrazinyl)naphthalene1sulfonicacid
CC1=NN(C(=O)C1=NNC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)O)C4=NC(=CS4)C5=CC=C(C=C5)OC
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc3c(c2S(=O)(=O)O)cccc3)C1=O)C
InChI=1SC24H19N5O5S2c11421(27261912915534618(15)22(19)36(3132)33)23(30)29(2814)242520(133524)1671017(342)11816h31326H12H3(H313233)b2721+
MFCD02025902
STK083933
ZINC000100005414
ZINC100341583

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Available files

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