Vitas-M small molecule compound
(3E)-6-(ethylsulfonyl)-3-[2-(furan-2-yl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STL241624
SMILES CCS(=O)(=O)c1ccc2c(c1)[nH]/c(=C/C(=O)c1ccco1)/c(=O)o2
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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 C16H13NO6S MW 347.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO6S/c1-2-24(20,21)10-5-6-14-11(8-10)17-12(16(19)23-14)9-13(18)15-4-3-7-22-15/h3-9,17H,2H2,1H3/b12-9+InChIKey
YRIINUSRBWQNLE-FMIVXFBMSA-NSynonyms
(3E)6(ethylsulfonyl)3(2(furan2yl)2oxoethylidene)34dihydro2H14benzoxazin2one
(3E)6ETHYLSULFONYL3(2(FURAN2YL)2OXOETHYLIDENE)4H14BENZOXAZIN2ONE
(E)6(ethylsulfonyl)3(2(furan2yl)2oxoethylidene)34dihydro2Hbenzo(b)(14)oxazin2one
CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=CC=CO3)N2
CCS(=O)(=O)c1ccc2c(c1)(nH)c(=CC(=O)c1ccco1)c(=O)o2
InChI=1SC16H13NO6Sc1224(2021)10561411(810)1712(16(19)2314)913(18)154372215h3917H2H21H3b129+
MFCD03289136
ZINC000100820596
ZINC100820596
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