Vitas-M small molecule compound

4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-3-methyl-1-(4-methylphenyl)-1H-pyrazol-5-ol

Catalog ID
STK834220
SMILES Cc1ccc(cc1)n1nc(c(c1O)C1SCc2c(CS1)cc(c(c2)C)C)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 C22H24N2OS2 MW 396.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2OS2/c1-13-5-7-19(8-6-13)24-21(25)20(16(4)23-24)22-26-11-17-9-14(2)15(3)10-18(17)12-27-22/h5-10,22,25H,11-12H2,1-4H3
InChIKey
UDJVOANVOPLBKB-UHFFFAOYSA-N
Synonyms

4(78dimethyl15dihydro24benzodithiepin3yl)3methyl1(4methylphenyl)1Hpyrazol5ol
4(78dimethyl15dihydrobenzo(e)(13)dithiepin3yl)3methyl1(ptolyl)1Hpyrazol5ol
MFCD01946318
ZINC000006199521

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.