Vitas-M small molecule compound

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

Catalog ID
STL350419
SMILES COc1cc(ccc1O)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 C17H19NO5S MW 349.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5S/c1-18-13(9-11-7-8-14(19)15(10-11)23-2)17(20)12-5-3-4-6-16(12)24(18,21)22/h3-8,10,13,17,19-20H,9H2,1-2H3
InChIKey
BNFCRDOWLALXBO-UHFFFAOYSA-N
Synonyms
929840-97-1
3((4hydroxy3methoxyphenyl)methyl)2methyl11dioxo34dihydro1$l^(6)2benzothiazin4ol
3(4hydroxy3methoxybenzyl)2methyl34dihydro2H12benzothiazin4ol11dioxide
4hydroxy3(4hydroxy3methoxybenzyl)2methyl34dihydro2Hbenzo(e)(12)thiazine11dioxide
929840971
CN1C(C(C2=CC=CC=C2S1(=O)=O)O)CC3=CC(=C(C=C3)O)OC
InChI=1SC17H19NO5Sc11813(9117814(19)15(1011)232)17(20)12534616(12)24(1821)22h381013171920H9H212H3
MFCD09845278
ZINC000009486268
ZINC000013654388

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Available files

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