Vitas-M small molecule compound

3,5-dimethyl-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-1-phenyl-1H-pyrazole-4-sulfonamide

Catalog ID
STK465336
SMILES CC1CCc2c(C1)sc(n2)NS(=O)(=O)c1c(C)nn(c1C)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 C19H22N4O2S2 MW 402.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O2S2/c1-12-9-10-16-17(11-12)26-19(20-16)22-27(24,25)18-13(2)21-23(14(18)3)15-7-5-4-6-8-15/h4-8,12H,9-11H2,1-3H3,(H,20,22)
InChIKey
XRXCAWYLSKTQPA-UHFFFAOYSA-N
Synonyms

35dimethylN(6methyl4567tetrahydro13benzothiazol2yl)1phenyl1Hpyrazole4sulfonamide
35dimethylN(6methyl4567tetrahydro13benzothiazol2yl)1phenylpyrazole4sulfonamide
CC1CCC2=C(C1)SC(=N2)NS(=O)(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C
InChI=1SC19H22N4O2S2c1129101617(1112)2619(2016)2227(2425)1813(2)2123(14(18)3)157546815h4812H911H213H3(H2022)
MFCD05145190
ZINC000017082528
ZINC000017082529

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Available files

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