Vitas-M small molecule compound

(3Z)-3-{[5-(4-fluorophenyl)furan-2-yl]methylidene}-2-(2-hydroxyethyl)-2,3-dihydro-4H-1,2-benzothiazin-4-one 1,1-dioxide

Catalog ID
STK643909
SMILES OCCN1/C(=C\c2ccc(o2)c2ccc(cc2)F)/C(=O)c2c(S1(=O)=O)cccc2

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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 C21H16FNO5S MW 413.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FNO5S/c22-15-7-5-14(6-8-15)19-10-9-16(28-19)13-18-21(25)17-3-1-2-4-20(17)29(26,27)23(18)11-12-24/h1-10,13,24H,11-12H2/b18-13-
InChIKey
OWHOYRCMBRQNPN-AQTBWJFISA-N
Synonyms
951945-85-0
(3Z)3((5(4fluorophenyl)furan2yl)methylidene)2(2hydroxyethyl)11dioxo1$l^(6)2benzothiazin4one
(3Z)3((5(4fluorophenyl)furan2yl)methylidene)2(2hydroxyethyl)23dihydro4H12benzothiazin4one11dioxide
(Z)3((5(4fluorophenyl)furan2yl)methylene)2(2hydroxyethyl)2Hbenzo(e)(12)thiazin4(3H)one11dioxide
951945850
C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)F)N(S2(=O)=O)CCO
InChI=1SC21H16FNO5Sc22157514(6815)1910916(2819)131821(25)17312420(17)29(2627)23(18)111224h1101324H1112H2b1813
MFCD09855554
OCCN1C(=Cc2ccc(o2)c2ccc(cc2)F)C(=O)c2c(S1(=O)=O)cccc2
ZINC000013722861
ZINC13722861

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Available files

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