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(6Z)-5-azanylidene-6-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

View entire compound with spectra: 1 MS (GC)

(6Z)-5-azanylidene-6-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID 1DxjFapOqv0
InChI InChI=1S/C27H28N4O4S/c1-4-8-19-10-6-7-11-21(19)34-14-15-35-22-13-12-18(17-23(22)33-3)16-20-25(28)31-27(29-26(20)32)36-24(30-31)9-5-2/h4,6-7,10-13,16-17,28H,1,5,8-9,14-15H2,2-3H3/b20-16-,28-25?
InChIKey HWGKBNATUKGNPH-MDHMIDBASA-N
Mol Weight 504.61 g/mol
Molecular Formula C27H28N4O4S
Exact Mass 504.183127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2tGNeR4xD81
Name (6Z)-5-azanylidene-6-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H28N4O4S
InChI InChI=1S/C27H28N4O4S/c1-4-8-19-10-6-7-11-21(19)34-14-15-35-22-13-12-18(17-23(22)33-3)16-20-25(28)31-27(29-26(20)32)36-24(30-31)9-5-2/h4,6-7,10-13,16-17,28H,1,5,8-9,14-15H2,2-3H3/b20-16-,28-25?
InChIKey HWGKBNATUKGNPH-MDHMIDBASA-N
Molecular Weight 504.605 g/mol
SMILES N=C1\C(C(=O)N=C2N1N=C(CCC)S2)=C\c1cc(OC)c(cc1)OCCOc1c(CC=C)cccc1
SPLASH splash10-014i-2910000000-ddcebc2391c74844bc4b
Synonyms (6Z)-5-imino-6-[[3-methoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[4-[2-(2-allylphenoxy)ethoxy]-3-methoxy-benzylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[[4-[2-(2-allylphenoxy)ethoxy]-3-methoxy-phenyl]methylene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Wiley ID 1453887