Vitas-M small molecule compound
(3Z)-2-(pyridin-4-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
STK633063
SMILES Cn1nc(c(c1C)/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1ccncc1)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)12-19-21(26)17-6-4-5-7-20(17)29(27,28)25(19)13-16-8-10-22-11-9-16/h4-12H,13H2,1-3H3/b19-12-InChIKey
BVDSUPKHCWYHJA-UNOMPAQXSA-NSynonyms
1010865-65-2(3Z)11dioxo2(pyridin4ylmethyl)3((135trimethylpyrazol4yl)methylidene)1$l^(6)2benzothiazin4one
(3Z)2(pyridin4ylmethyl)3((135trimethyl1Hpyrazol4yl)methylidene)23dihydro4H12benzothiazin4one11dioxide
(Z)2(pyridin4ylmethyl)3((135trimethyl1Hpyrazol4yl)methylene)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
1010865652
CC1=C(C(=NN1C)C)C=C2C(=O)C3=CC=CC=C3S(=O)(=O)N2CC4=CC=NC=C4
Cn1nc(c(c1C)C=C1C(=O)c2ccccc2S(=O)(=O)N1Cc1ccncc1)C
InChI=1SC21H20N4O3Sc11418(15(2)24(3)2314)121921(26)17645720(17)29(2728)25(19)13168102211916h412H13H213H3b1912
MFCD09858169
ZINC000013733081
ZINC13733081
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