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1,3-Benzoxazol-2(3H)-one, 5-chloro-6-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-3-methyl-
SpectraBase Compound ID 4ZiiW0TJFjl
InChI InChI=1S/C18H17ClFN3O4S/c1-21-15-10-12(19)17(11-16(15)27-18(21)24)28(25,26)23-8-6-22(7-9-23)14-5-3-2-4-13(14)20/h2-5,10-11H,6-9H2,1H3
InChIKey IHVYZDOAQILWEO-UHFFFAOYSA-N
Mol Weight 425.86 g/mol
Molecular Formula C18H17ClFN3O4S
Exact Mass 425.061233 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vZeuwC47oO
Name 1,3-Benzoxazol-2(3H)-one, 5-chloro-6-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-3-methyl-
Alternate Name(s) 5-Chloro-6-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-3-methyl-1,3-benzoxazol-2-one 5-Chloro-6-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one 5-Chloranyl-6-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-3-methyl-1,3-benzoxazol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17ClFN3O4S
InChI InChI=1S/C18H17ClFN3O4S/c1-21-15-10-12(19)17(11-16(15)27-18(21)24)28(25,26)23-8-6-22(7-9-23)14-5-3-2-4-13(14)20/h2-5,10-11H,6-9H2,1H3
InChIKey IHVYZDOAQILWEO-UHFFFAOYSA-N
Molecular Weight 425.862 g/mol
SMILES c1(ccccc1N1CCN(CC1)S(=O)(c1cc2c(cc1Cl)N(C)C(=O)O2)=O)F
SPLASH splash10-056r-5900000000-0700076fd3a3830274f6
Source of Spectrum IY-1-4667-3
Wiley ID 1654656