Vitas-M small molecule compound

3-(2,3-dimethoxybenzyl)-2-methyl-3,4-dihydro-2H-1,2-benzothiazin-4-ol 1,1-dioxide

Catalog ID
STK634645
SMILES COc1c(cccc1OC)CC1C(O)c2ccccc2S(=O)(=O)N1C

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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 C18H21NO5S MW 363.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5S/c1-19-14(11-12-7-6-9-15(23-2)18(12)24-3)17(20)13-8-4-5-10-16(13)25(19,21)22/h4-10,14,17,20H,11H2,1-3H3
InChIKey
UTBCXDAFTPBUCD-UHFFFAOYSA-N
Synonyms
929850-67-9
3((23dimethoxyphenyl)methyl)2methyl11dioxo34dihydro1$l^(6)2benzothiazin4ol
3(23dimethoxybenzyl)2methyl34dihydro2H12benzothiazin4ol11dioxide
3(23dimethoxybenzyl)4hydroxy2methyl34dihydro2Hbenzo(e)(12)thiazine11dioxide
929850679
CN1C(C(C2=CC=CC=C2S1(=O)=O)O)CC3=C(C(=CC=C3)OC)OC
InChI=1SC18H21NO5Sc11914(111276915(232)18(12)243)17(20)138451016(13)25(1921)22h410141720H11H213H3
MFCD09846186
ZINC000009547853
ZINC000013654693

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Available files

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