Vitas-M small molecule compound

methyl 2-({[4-(1,1-dioxido-1,2-thiazinan-2-yl)-2,6-dimethylphenyl]sulfonyl}amino)benzoate

Catalog ID
STK640641
SMILES COC(=O)c1ccccc1NS(=O)(=O)c1c(C)cc(cc1C)N1CCCCS1(=O)=O

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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 C20H24N2O6S2 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O6S2/c1-14-12-16(22-10-6-7-11-29(22,24)25)13-15(2)19(14)30(26,27)21-18-9-5-4-8-17(18)20(23)28-3/h4-5,8-9,12-13,21H,6-7,10-11H2,1-3H3
InChIKey
HKJSLCRNAGXEIB-UHFFFAOYSA-N
Synonyms
919981-17-2
919981172
CC1=CC(=CC(=C1S(=O)(=O)NC2=CC=CC=C2C(=O)OC)C)N3CCCCS3(=O)=O
InChI=1SC20H24N2O6S2c1141216(2210671129(2224)25)1315(2)19(14)30(2627)2118954817(18)20(23)283h4589121321H671011H213H3
methyl2(((4(11dioxido12thiazinan2yl)26dimethylphenyl)sulfonyl)amino)benzoate
methyl2((4(11dioxothiazinan2yl)26dimethylphenyl)sulfonylamino)benzoate
methyl2(4(11dioxido12thiazinan2yl)26dimethylphenylsulfonamido)benzoate
MFCD10044325
ZINC000011906623
ZINC11906623

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Available files

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