Vitas-M small molecule compound

methyl 3-({[3-(1,1-dioxido-1,2-thiazinan-2-yl)phenyl]carbonyl}amino)benzoate

Catalog ID
STK653525
SMILES COC(=O)c1cccc(c1)NC(=O)c1cccc(c1)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 C19H20N2O5S MW 388.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O5S/c1-26-19(23)15-7-4-8-16(12-15)20-18(22)14-6-5-9-17(13-14)21-10-2-3-11-27(21,24)25/h4-9,12-13H,2-3,10-11H2,1H3,(H,20,22)
InChIKey
KJXOKIGLCUDOQN-UHFFFAOYSA-N
Synonyms
1011880-80-0
1011880800
COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)N3CCCCS3(=O)=O
InChI=1SC19H20N2O5Sc12619(23)1574816(1215)2018(22)1465917(1314)2110231127(2124)25h491213H231011H21H3(H2022)
methyl3(((3(11dioxido12thiazinan2yl)phenyl)carbonyl)amino)benzoate
methyl3((3(11dioxothiazinan2yl)benzoyl)amino)benzoate
methyl3(3(11dioxido12thiazinan2yl)benzamido)benzoate
MFCD10078763
ZINC000012194529
ZINC12194529

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Available files

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