Vitas-M small molecule compound
(3Z)-2-(pyridin-3-ylmethyl)-3-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide
Catalog ID
STL237511
SMILES Cn1nc(c(c1C)/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1cccnc1)C
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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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-14-18(15(2)24(3)23-14)11-19-21(26)17-8-4-5-9-20(17)29(27,28)25(19)13-16-7-6-10-22-12-16/h4-12H,13H2,1-3H3/b19-11-InChIKey
QRVGHSMACZVWAG-ODLFYWEKSA-NSynonyms
1010864-57-9(3Z)11dioxo2(pyridin3ylmethyl)3((135trimethylpyrazol4yl)methylidene)1$l^(6)2benzothiazin4one
(3Z)2(pyridin3ylmethyl)3((135trimethyl1Hpyrazol4yl)methylidene)23dihydro4H12benzothiazin4one11dioxide
(Z)2(pyridin3ylmethyl)3((135trimethyl1Hpyrazol4yl)methylene)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
1010864579
CC1=C(C(=NN1C)C)C=C2C(=O)C3=CC=CC=C3S(=O)(=O)N2CC4=CN=CC=C4
Cn1nc(c(c1C)C=C1C(=O)c2ccccc2S(=O)(=O)N1Cc1cccnc1)C
InChI=1SC21H20N4O3Sc11418(15(2)24(3)2314)111921(26)17845920(17)29(2728)25(19)13167610221216h412H13H213H3b1911
MFCD09856691
ZINC000013727431
ZINC13727431
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