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N-[4-(aminosulfonyl)phenyl]-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide

View entire compound with spectra: 2 NMR

N-[4-(aminosulfonyl)phenyl]-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide
SpectraBase Compound ID rWOROYM1Tw
InChI InChI=1S/C17H14ClN3O4S/c1-10-15(16(21-25-10)13-4-2-3-5-14(13)18)17(22)20-11-6-8-12(9-7-11)26(19,23)24/h2-9H,1H3,(H,20,22)(H2,19,23,24)
InChIKey HXYBWSVSYAKWMS-UHFFFAOYSA-N
Mol Weight 391.83 g/mol
Molecular Formula C17H14ClN3O4S
Exact Mass 391.039355 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JcgsbpSWmQJ
Name N-[4-(Aminosulfonyl)phenyl]-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 391.039354813 u
Formula C17H14ClN3O4S
InChI InChI=1S/C17H14ClN3O4S/c1-10-15(16(21-25-10)13-4-2-3-5-14(13)18)17(22)20-11-6-8-12(9-7-11)26(19,23)24/h2-9H,1H3,(H,20,22)(H2,19,23,24)
InChIKey HXYBWSVSYAKWMS-UHFFFAOYSA-N
Molecular Weight 391.829 g/mol
SMILES N(C(C=1C(=NOC1C)C1=C(Cl)C=CC=C1)=O)C=1C=CC(S(=O)(=O)N)=CC1