Vitas-M small molecule compound
4-[1-(2-chlorobenzyl)-1H-pyrazol-4-yl]-5-[1-(methylsulfonyl)piperidin-3-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK309664
SMILES Sc1nnc(n1c1cnn(c1)Cc1ccccc1Cl)C1CCCN(C1)S(=O)(=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 C18H21ClN6O2S2 MW 452.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN6O2S2/c1-29(26,27)24-8-4-6-14(11-24)17-21-22-18(28)25(17)15-9-20-23(12-15)10-13-5-2-3-7-16(13)19/h2-3,5,7,9,12,14H,4,6,8,10-11H2,1H3,(H,22,28)InChIKey
BIHVFYQRNSBHPZ-UHFFFAOYSA-NSynonyms
1005680-21-61005680216
4(1((2CHLOROPHENYL)METHYL)PYRAZOL4YL)3(1METHYLSULFONYLPIPERIDIN3YL)1H124TRIAZOLE5THIONE
4(1(2chlorobenzyl)1Hpyrazol4yl)5(1(methylsulfonyl)piperidin3yl)4H124triazole3thiol
CS(=O)(=O)N1CCCC(C1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4Cl
InChI=1SC18H21ClN6O2S2c129(2627)2484614(1124)17212218(28)25(17)1592023(1215)1013523716(13)19h235791214H4681011H21H3(H2228)
MFCD04052959
ZINC000002802614
ZINC000002802615
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