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Benzamide, N-[2-[(butylimino)phenylmethyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl]-4-nitro-
SpectraBase Compound ID D7x9piFDnxr
InChI InChI=1S/C28H28N4O4S/c1-4-5-15-29-24(19-9-7-6-8-10-19)26-25(23-21(17-36-3)16-18(2)30-28(23)37-26)31-27(33)20-11-13-22(14-12-20)32(34)35/h6-14,16H,4-5,15,17H2,1-3H3,(H,31,33)/b29-24+
InChIKey KQPPWSWMPDYLHA-RMLRFSFXSA-N
Mol Weight 516.62 g/mol
Molecular Formula C28H28N4O4S
Exact Mass 516.183127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8SBTCb5CH9O
Name Benzamide, N-[2-[(butylimino)phenylmethyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl]-4-nitro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H28N4O4S
InChI InChI=1S/C28H28N4O4S/c1-4-5-15-29-24(19-9-7-6-8-10-19)26-25(23-21(17-36-3)16-18(2)30-28(23)37-26)31-27(33)20-11-13-22(14-12-20)32(34)35/h6-14,16H,4-5,15,17H2,1-3H3,(H,31,33)/b29-24+
InChIKey KQPPWSWMPDYLHA-RMLRFSFXSA-N
Molecular Weight 516.616 g/mol
SMILES N(c1c(sc2nc(C)cc(c12)COC)\C(=N\CCCC)c1ccccc1)C(c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-0udi-5900000000-9f5b37ad1d94ca0789e8
Source of Spectrum IY-2-5053-4
Synonyms N-{2-[(1E)-(butylimino)(phenyl)methyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl}-4-nitrobenzamide
Wiley ID 1658517