Vitas-M small molecule compound

3-{[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-2-methyl-3,4-dihydro-2H-1,2-benzothiazin-4-ol 1,1-dioxide

Catalog ID
STK640057
SMILES COc1ccc(cc1)c1[nH]ncc1CC1C(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 C20H21N3O4S MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O4S/c1-23-17(20(24)16-5-3-4-6-18(16)28(23,25)26)11-14-12-21-22-19(14)13-7-9-15(27-2)10-8-13/h3-10,12,17,20,24H,11H2,1-2H3,(H,21,22)
InChIKey
VPOJIKDBSRIGNN-UHFFFAOYSA-N
Synonyms
1049798-69-7
1049798697
3((5(4methoxyphenyl)1Hpyrazol4yl)methyl)2methyl11dioxo34dihydro1$l^(6)2benzothiazin4ol
3((5(4methoxyphenyl)1Hpyrazol4yl)methyl)2methyl34dihydro2H12benzothiazin4ol11dioxide
4hydroxy3((3(4methoxyphenyl)1Hpyrazol4yl)methyl)2methyl34dihydro2Hbenzo(e)(12)thiazine11dioxide
CN1C(C(C2=CC=CC=C2S1(=O)=O)O)CC3=C(NN=C3)C4=CC=C(C=C4)OC
COc1ccc(cc1)c1(nH)ncc1CC1C(O)c2ccccc2S(=O)(=O)N1C
COc1ccc(cc1)c1n(nH)cc1CC1C(O)c2ccccc2S(=O)(=O)N1C
InChI=1SC20H21N3O4Sc12317(20(24)16534618(16)28(2325)26)111412212219(14)137915(272)10813h31012172024H11H212H3(H2122)
MFCD18162208
ZINC000013727651
ZINC000013727660

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Available files

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