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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[5-(3-chlorophenyl)-2-furanyl]methylene]-5,6-dihydro-5-imino-2-propyl-, (6Z)-
SpectraBase Compound ID GGhspahu3cI
InChI InChI=1S/C19H15ClN4O2S/c1-2-4-16-23-24-17(21)14(18(25)22-19(24)27-16)10-13-7-8-15(26-13)11-5-3-6-12(20)9-11/h3,5-10,21H,2,4H2,1H3/b14-10-,21-17?
InChIKey MLYLVZHSGJLACW-QBILMKHKSA-N
Mol Weight 398.87 g/mol
Molecular Formula C19H15ClN4O2S
Exact Mass 398.060425 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ABcCg7MYA1P
Name (6Z)-5-azanylidene-6-[[5-(3-chlorophenyl)furan-2-yl]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 C19H15ClN4O2S
InChI InChI=1S/C19H15ClN4O2S/c1-2-4-16-23-24-17(21)14(18(25)22-19(24)27-16)10-13-7-8-15(26-13)11-5-3-6-12(20)9-11/h3,5-10,21H,2,4H2,1H3/b14-10-,21-17?
InChIKey MLYLVZHSGJLACW-QBILMKHKSA-N
Molecular Weight 398.868 g/mol
SMILES N=C1\C(C(=O)N=C2N1N=C(CCC)S2)=C\c1oc(-c2cc(Cl)ccc2)cc1
SPLASH splash10-0a4i-9671000000-8629da29be4721f95c2d
Synonyms (6Z)-6-[[5-(3-chlorophenyl)-2-furanyl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[[5-(3-chlorophenyl)-2-furyl]methylene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[[5-(3-chlorophenyl)furan-2-yl]methylidene]-5-imino-2-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Wiley ID 1464080