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D,L-N,N'-(methylene-di-4,1-phenylene)-bis-{2-phenyl-2-[(thiobenzoyl)thio]acetamide}
SpectraBase Compound ID 8nLrlcQrmEI
InChI InChI=1S/C43H34N2O2S4/c46-40(38(32-13-5-1-6-14-32)50-42(48)34-17-9-3-10-18-34)44-36-25-21-30(22-26-36)29-31-23-27-37(28-24-31)45-41(47)39(33-15-7-2-8-16-33)51-43(49)35-19-11-4-12-20-35/h1-28,38-39H,29H2,(H,44,46)(H,45,47)
InChIKey RMDWWHKNWNHRBM-UHFFFAOYSA-N
Mol Weight 739.0 g/mol
Molecular Formula C43H34N2O2S4
Exact Mass 738.150313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABANcX9DsdW
Name D,L-N,N'-(methylene-di-4,1-phenylene)-bis-{2-phenyl-2-[(thiobenzoyl)thio]acetamide}
CAS Registry Number 107960-50-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H34N2O2S4
InChI InChI=1S/C43H34N2O2S4/c46-40(38(32-13-5-1-6-14-32)50-42(48)34-17-9-3-10-18-34)44-36-25-21-30(22-26-36)29-31-23-27-37(28-24-31)45-41(47)39(33-15-7-2-8-16-33)51-43(49)35-19-11-4-12-20-35/h1-28,38-39H,29H2,(H,44,46)(H,45,47)
InChIKey RMDWWHKNWNHRBM-UHFFFAOYSA-N
Molecular Weight 738.997 g/mol
SMILES N(C(C(SC(=S)c1ccccc1)c1ccccc1)=O)c1ccc(Cc2ccc(NC(C(SC(=S)c3ccccc3)c3ccccc3)=O)cc2)cc1
SPLASH splash10-03fr-7910000000-6cd31bcf4d6d8c562636
Source of Spectrum K-120-1020-5
Synonyms 2-[4-(4-{[(benzothioylsulfanyl)(phenyl)acetyl]amino}benzyl)anilino]-2-oxo-1-phenylethyl benzenecarbodithioate
Wiley ID 1416074