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2-[(4-CHLOROPHENYL)-SULFONYL]-4-[2-(1H-INDOL-3-YL)-ETHYL]-5-METHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
SpectraBase Compound ID CpQrCXx8JVP
InChI InChI=1S/C15H16ClN5O3S/c1-12-18-21(25(23,24)14-5-3-13(16)4-6-14)15(22)20(12)9-2-8-19-10-7-17-11-19/h3-7,10-11H,2,8-9H2,1H3
InChIKey KFSFAPOVUJVVAB-UHFFFAOYSA-N
Mol Weight 381.84 g/mol
Molecular Formula C15H16ClN5O3S
Exact Mass 381.066238 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3LssdXatXNL
Name 2-[(4-CHLOROPHENYL)-SULFONYL]-4-[2-(1H-INDOL-3-YL)-ETHYL]-5-METHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16ClN5O3S
InChI InChI=1S/C15H16ClN5O3S/c1-12-18-21(25(23,24)14-5-3-13(16)4-6-14)15(22)20(12)9-2-8-19-10-7-17-11-19/h3-7,10-11H,2,8-9H2,1H3
InChIKey KFSFAPOVUJVVAB-UHFFFAOYSA-N
Literature Reference Author H.BEKTAS,N.KARAALI,D.SAHIN,A.DEMIRBAS,S.A.KARAOGLU,N.DEMIRBA S
Literature Reference Citation MOLECULES,15,2427(2010)
Literature Reference DOI 10.3390/molecules15042427
Molecular Weight 381.837 g/mol
Sample ID 70255
Solvent DMSO-D6