Vitas-M small molecule compound

N-[1-(2-fluorobenzyl)-1H-pyrazol-4-yl]-2-[(1,3,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-4-yl)carbonyl]hydrazinecarbothioamide

Catalog ID
STL396131
SMILES S=C(Nc1cnn(c1)Cc1ccccc1F)NNC(=O)c1cc(C)nc2c1c(C)nn2C

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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 C21H21FN8OS MW 452.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN8OS/c1-12-8-16(18-13(2)28-29(3)19(18)24-12)20(31)26-27-21(32)25-15-9-23-30(11-15)10-14-6-4-5-7-17(14)22/h4-9,11H,10H2,1-3H3,(H,26,31)(H2,25,27,32)
InChIKey
XPFHCXGVMARUHL-UHFFFAOYSA-N
Synonyms
1005688-64-1
1(1((2fluorophenyl)methyl)pyrazol4yl)3((136trimethylpyrazolo(34b)pyridine4carbonyl)amino)thiourea
1005688641
CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)NNC(=S)NC3=CN(N=C3)CC4=CC=CC=C4F
InChI=1SC21H21FN8OSc112816(1813(2)2829(3)19(18)2412)20(31)262721(32)251592330(1115)1014645717(14)22h4911H10H213H3(H2631)(H2252732)
MFCD06196411
N(1(2FLUOROBENZYL)1HPYRAZOL4YL)2((136TRIMETHYL1HPYRAZOLO(34B)PYRIDIN4YL)CARBONYL)HYDRAZINECARBOTHIOAMIDE
ZINC000022533611
ZINC22533611

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Available files

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