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N-(1-[(Benzylsulfanyl)methyl]-2-[(2E)-2-(1-methylpentylidene)hydrazino]-2-oxoethyl)-4-nitrobenzamide
SpectraBase Compound ID AdRGVtbWGvG
InChI InChI=1S/C23H28N4O4S/c1-3-4-8-17(2)25-26-23(29)21(16-32-15-18-9-6-5-7-10-18)24-22(28)19-11-13-20(14-12-19)27(30)31/h5-7,9-14,21H,3-4,8,15-16H2,1-2H3,(H,24,28)(H,26,29)/b25-17+
InChIKey YRLBKCBGPGBDLC-KOEQRZSOSA-N
Mol Weight 456.56 g/mol
Molecular Formula C23H28N4O4S
Exact Mass 456.183127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FVFOGPIvHzK
Name N-(1-[(Benzylsulfanyl)methyl]-2-[(2E)-2-(1-methylpentylidene)hydrazino]-2-oxoethyl)-4-nitrobenzamide
CAS Registry Number 322682-80-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28N4O4S
InChI InChI=1S/C23H28N4O4S/c1-3-4-8-17(2)25-26-23(29)21(16-32-15-18-9-6-5-7-10-18)24-22(28)19-11-13-20(14-12-19)27(30)31/h5-7,9-14,21H,3-4,8,15-16H2,1-2H3,(H,24,28)(H,26,29)/b25-17+
InChIKey YRLBKCBGPGBDLC-KOEQRZSOSA-N
Molecular Weight 456.561 g/mol
SMILES N(C(c1ccc(cc1)N(=O)=O)=O)C(C(=O)N\N=C/(C)CCCC)CSCc1ccccc1
SPLASH splash10-0006-9600000000-eadb00a88ee82df06026
Synonyms N-[1-[(2E)-2-hexan-2-ylidenehydrazinyl]-1-oxidanylidene-3-(phenylmethylsulfanyl)propan-2-yl]-4-nitro-benzamide N-[1-[(2E)-2-hexan-2-ylidenehydrazinyl]-1-oxo-3-(phenylmethylthio)propan-2-yl]-4-nitrobenzamide N-[1-[(benzylthio)methyl]-2-keto-2-[(N'E)-N'-(1-methylpentylidene)hydrazino]ethyl]-4-nitro-benzamide N-[3-benzylsulfanyl-1-[(2E)-2-hexan-2-ylidenehydrazinyl]-1-oxopropan-2-yl]-4-nitrobenzamide S-Benzyl-N2-(4-nitrobenzoyl)cysteine N'-(1-methylpentylidene)hydrazide
Wiley ID 1468000