Vitas-M small molecule compound
(3Z)-6-(ethylsulfonyl)-3-[2-(4-fluorophenyl)-2-oxoethylidene]-3,4-dihydro-2H-1,4-benzoxazin-2-one
Catalog ID
STK767570
SMILES CCS(=O)(=O)c1ccc2c(c1)[nH]/c(=C\C(=O)c1ccc(cc1)F)/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 C18H14FNO5S MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14FNO5S/c1-2-26(23,24)13-7-8-17-14(9-13)20-15(18(22)25-17)10-16(21)11-3-5-12(19)6-4-11/h3-10,20H,2H2,1H3/b15-10-InChIKey
QKICUSRAMZICAI-GDNBJRDFSA-NSynonyms
(3Z)6(ethylsulfonyl)3(2(4fluorophenyl)2oxoethylidene)34dihydro2H14benzoxazin2one
(3Z)6ETHYLSULFONYL3(2(4FLUOROPHENYL)2OXOETHYLIDENE)4H14BENZOXAZIN2ONE
(E)6(ethylsulfonyl)3(2(4fluorophenyl)2oxoethylidene)34dihydro2Hbenzo(b)(14)oxazin2one
6(ETHYLSULFONYL)3(2(4FLUOROPHENYL)2OXOETHYLIDENE)4HBENZO(E)14OXAZIN2ONE
6ETHANESULFONYL3(2(4FLUOROPHENYL)2OXOETHYLIDENE)34DIHYDROBENZO(14)OXAZIN2ONE
CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=CC=C(C=C3)F)N2
CCS(=O)(=O)c1ccc2c(c1)(nH)c(=CC(=O)c1ccc(cc1)F)c(=O)o2
InChI=1SC18H14FNO5Sc1226(2324)13781714(913)2015(18(22)2517)1016(21)113512(19)6411h31020H2H21H3b1510
MFCD03034723
ZINC000100113647
ZINC100113647
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