Vitas-M small molecule compound

2-benzyl-3-(pyridin-4-ylmethyl)-3,4-dihydro-2H-1,2-benzothiazin-4-ol 1,1-dioxide

Catalog ID
STK625865
SMILES OC1C(Cc2ccncc2)N(Cc2ccccc2)S(=O)(=O)c2c1cccc2

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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 C21H20N2O3S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3S/c24-21-18-8-4-5-9-20(18)27(25,26)23(15-17-6-2-1-3-7-17)19(21)14-16-10-12-22-13-11-16/h1-13,19,21,24H,14-15H2
InChIKey
YBIPUPJGXZPJHT-UHFFFAOYSA-N
Synonyms
929847-66-5
2benzyl11dioxo3(pyridin4ylmethyl)34dihydro1$l^(6)2benzothiazin4ol
2benzyl3(pyridin4ylmethyl)34dihydro2H12benzothiazin4ol11dioxide
2benzyl4hydroxy3(pyridin4ylmethyl)34dihydro2Hbenzo(e)(12)thiazine11dioxide
929847665
C1=CC=C(C=C1)CN2C(C(C3=CC=CC=C3S2(=O)=O)O)CC4=CC=NC=C4
InChI=1SC21H20N2O3Sc242118845920(18)27(2526)23(15176213717)19(21)1416101222131116h113192124H1415H2
MFCD09795370
ZINC000009422049
ZINC000013654110

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Available files

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