Vitas-M small molecule compound

ethyl 4-({[(1,3-diphenyl-1H-pyrazol-4-yl)methyl]carbamothioyl}amino)benzoate

Catalog ID
STK456430
SMILES CCOC(=O)c1ccc(cc1)NC(=S)NCc1cn(nc1c1ccccc1)c1ccccc1

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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 C26H24N4O2S MW 456.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O2S/c1-2-32-25(31)20-13-15-22(16-14-20)28-26(33)27-17-21-18-30(23-11-7-4-8-12-23)29-24(21)19-9-5-3-6-10-19/h3-16,18H,2,17H2,1H3,(H2,27,28,33)
InChIKey
LLXVYSLPMOTILD-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4
ETHYL4(((((13DIPHENYLPYRAZOL4YL)METHYL)AMINO)THIOXOMETHYL)AMINO)BENZOATE
ethyl4((((13diphenyl1Hpyrazol4yl)methyl)carbamothioyl)amino)benzoate
ETHYL4((13DIPHENYLPYRAZOL4YL)METHYLCARBAMOTHIOYLAMINO)BENZOATE
InChI=1SC26H24N4O2Sc123225(31)20131522(161420)2826(33)2717211830(23117481223)2924(21)1995361019h31618H217H21H3(H2272833)
MFCD05100504
ZINC000002851306
ZINC02851306
ZINC2851306

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Available files

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