Vitas-M small molecule compound

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

Catalog ID
STK638655
SMILES Oc1ccc(cc1)CC1C(O)c2ccccc2S(=O)(=O)N1Cc1ccncc1

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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 C21H20N2O4S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4S/c24-17-7-5-15(6-8-17)13-19-21(25)18-3-1-2-4-20(18)28(26,27)23(19)14-16-9-11-22-12-10-16/h1-12,19,21,24-25H,13-14H2
InChIKey
JGPXKHCCVWZLNC-UHFFFAOYSA-N
Synonyms
951966-13-5
3((4hydroxyphenyl)methyl)11dioxo2(pyridin4ylmethyl)34dihydro1$l^(6)2benzothiazin4ol
3(4hydroxybenzyl)2(pyridin4ylmethyl)34dihydro2H12benzothiazin4ol11dioxide
4hydroxy3(4hydroxybenzyl)2(pyridin4ylmethyl)34dihydro2Hbenzo(e)(12)thiazine11dioxide
951966135
C1=CC=C2C(=C1)C(C(N(S2(=O)=O)CC3=CC=NC=C3)CC4=CC=C(C=C4)O)O
InChI=1SC21H20N2O4Sc24177515(6817)131921(25)18312420(18)28(2627)23(19)141691122121016h11219212425H1314H2
MFCD09853813
ZINC000013692954
ZINC000013692957

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Available files

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