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Phenyl imine - derivative of thiangazole
SpectraBase Compound ID 7OzFCT4D4zO
InChI InChI=1S/C25H28N6O2S3/c1-15-18(19(32)26-5)28-20(33-15)23(2)12-35-22(30-23)25(4)14-36-21(31-25)24(3)13-34-17(29-24)11-27-16-9-7-6-8-10-16/h6-11H,12-14H2,1-5H3,(H,26,32)/b27-11+/t23-,24-,25-/m0/s1
InChIKey JROMTUCJMIHMDJ-OJTTZEQUSA-N
Mol Weight 540.72 g/mol
Molecular Formula C25H28N6O2S3
Exact Mass 540.143588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TzNSmxVs1V
Name Phenyl imine - derivative of thiangazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28N6O2S3
InChI InChI=1S/C25H28N6O2S3/c1-15-18(19(32)26-5)28-20(33-15)23(2)12-35-22(30-23)25(4)14-36-21(31-25)24(3)13-34-17(29-24)11-27-16-9-7-6-8-10-16/h6-11H,12-14H2,1-5H3,(H,26,32)/b27-11+/t23-,24-,25-/m0/s1
InChIKey JROMTUCJMIHMDJ-OJTTZEQUSA-N
Molecular Weight 540.719 g/mol
SMILES N(C(c1nc([C@]2(N=C([C@]3(N=C([C@]4(N=C(\C=N\c5ccccc5)SC4)C)SC3)C)SC2)C)oc1C)=O)C
SPLASH splash10-004i-0129000000-d6dec4bc3d1a1984abdd
Source of Spectrum U1-1999-3389-36
Synonyms N,5-dimethyl-2-[(4R)-4-methyl-2-[(4S)-4-methyl-2-[(4S)-4-methyl-2-(N-phenylcarboximidoyl)-4,5-dihydro-1,3-thiazol-4-yl]-4,5-dihydro-1,3-thiazol-4-yl]-4,5-dihydro-1,3-thiazol-4-yl]-1,3-oxazole-4-carboxamide
Wiley ID 753455