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3-Anilino-N-(benzothiazol-2-yl)-5-((2-oxo-1,2-dihydro-3Hindol-3-ylidene)amino)-1H-pyrazole-4-carboxamide
SpectraBase Compound ID CZJPHhfji3V
InChI InChI=1S/C25H17N7O2S/c33-23(30-25-28-17-12-6-7-13-18(17)35-25)19-21(26-14-8-2-1-3-9-14)31-32-22(19)29-20-15-10-4-5-11-16(15)27-24(20)34/h1-13H,(H,28,30,33)(H3,26,27,29,31,32,34)
InChIKey HLKIZBWWXQEILL-UHFFFAOYSA-N
Mol Weight 479.52 g/mol
Molecular Formula C25H17N7O2S
Exact Mass 479.116444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dJr2SDwBGX
Name 3-Anilino-N-(benzothiazol-2-yl)-5-((2-oxo-1,2-dihydro-3Hindol-3-ylidene)amino)-1H-pyrazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H17N7O2S
InChI InChI=1S/C25H17N7O2S/c33-23(30-25-28-17-12-6-7-13-18(17)35-25)19-21(26-14-8-2-1-3-9-14)31-32-22(19)29-20-15-10-4-5-11-16(15)27-24(20)34/h1-13H,(H,28,30,33)(H3,26,27,29,31,32,34)
InChIKey HLKIZBWWXQEILL-UHFFFAOYSA-N
Molecular Weight 479.518 g/mol
SMILES N(c1c(C(Nc2nc3ccccc3s2)=O)c(\N=C\2C(Nc3c2cccc3)=O)[nH]n1)c1ccccc1
SPLASH splash10-0032-4903200000-fc847c40e618073087c5
Source of Spectrum F2-45-3700-26
Synonyms 5-Anilino-N-(1,3-benzothiazol-2-yl)-3-[(2-oxo-3-indolyl)amino]-1H-pyrazole-4-carboxamide 5-Anilino-N-(1,3-benzothiazol-2-yl)-3-[(2-oxoindol-3-yl)amino]-1H-pyrazole-4-carboxamide N-(1,3-benzothiazol-2-yl)-3-[(2-oxidanylideneindol-3-yl)amino]-5-phenylazanyl-1H-pyrazole-4-carboxamide
Wiley ID 1703325