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4-(1-Benzyl-3-tosylureido)-2-(3,4,5-trimethoxyphenyl)-2-oxazoline
SpectraBase Compound ID G1togS7sjHk
InChI InChI=1S/C27H29N3O7S/c1-18-10-12-21(13-11-18)38(32,33)29-27(31)30(16-19-8-6-5-7-9-19)24-17-37-26(28-24)20-14-22(34-2)25(36-4)23(15-20)35-3/h5-15,24H,16-17H2,1-4H3,(H,29,31)
InChIKey BWQGFRHKSUAEKC-UHFFFAOYSA-N
Mol Weight 539.6 g/mol
Molecular Formula C27H29N3O7S
Exact Mass 539.172621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKdLvbTUgoa
Name 4-(1-Benzyl-3-tosylureido)-2-(3,4,5-trimethoxyphenyl)-2-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H29N3O7S
InChI InChI=1S/C27H29N3O7S/c1-18-10-12-21(13-11-18)38(32,33)29-27(31)30(16-19-8-6-5-7-9-19)24-17-37-26(28-24)20-14-22(34-2)25(36-4)23(15-20)35-3/h5-15,24H,16-17H2,1-4H3,(H,29,31)
InChIKey BWQGFRHKSUAEKC-UHFFFAOYSA-N
Molecular Weight 539.603 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(N(C1N=C(c2cc(OC)c(c(c2)OC)OC)OC1)Cc1ccccc1)=O
SPLASH splash10-002g-9824000000-c231e941e22155444ffb
Source of Spectrum F-62-6177-2
Synonyms 4-[benzyl({[(4-methylphenyl)sulfonyl]amino}carbonyl)amino]-2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1,3-oxazole
Wiley ID 1633969