Vitas-M small molecule compound
[4-(4-bromo-3-methylphenyl)-6-fluoro-1,1-dioxido-4H-1,4-benzothiazin-2-yl](pyrrolidin-1-yl)methanone
Catalog ID
STL097168
SMILES Fc1ccc2c(c1)N(C=C(S2(=O)=O)C(=O)N1CCCC1)c1ccc(c(c1)C)Br
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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 C20H18BrFN2O3S MW 465.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrFN2O3S/c1-13-10-15(5-6-16(13)21)24-12-19(20(25)23-8-2-3-9-23)28(26,27)18-7-4-14(22)11-17(18)24/h4-7,10-12H,2-3,8-9H2,1H3InChIKey
RPHCYAGZRHXGGB-UHFFFAOYSA-NSynonyms
(4(4bromo3methylphenyl)6fluoro11dioxido4H14benzothiazin2yl)(pyrrolidin1yl)methanone
(4(4bromo3methylphenyl)6fluoro11dioxo1$l^(6)4benzothiazin2yl)pyrrolidin1ylmethanone
CC1=C(C=CC(=C1)N2C=C(S(=O)(=O)C3=C2C=C(C=C3)F)C(=O)N4CCCC4)Br
InChI=1SC20H18BrFN2O3Sc1131015(5616(13)21)241219(20(25)23823923)28(2627)187414(22)1117(18)24h471012H2389H21H3
MFCD18788949
ZINC000067245529
ZINC67245529
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