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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[5-(4-chlorophenyl)-2-furanyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID 8duc4VGu6gX
InChI InChI=1S/C19H15ClN4O2S/c1-10(2)18-23-24-16(21)14(17(25)22-19(24)27-18)9-13-7-8-15(26-13)11-3-5-12(20)6-4-11/h3-10,21H,1-2H3/b14-9-,21-16?
InChIKey IPOGJLOCODZXKO-AJUKGGFZSA-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 9tIACmUbgLM
Name (6Z)-5-azanylidene-6-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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Formula C19H15ClN4O2S
InChI InChI=1S/C19H15ClN4O2S/c1-10(2)18-23-24-16(21)14(17(25)22-19(24)27-18)9-13-7-8-15(26-13)11-3-5-12(20)6-4-11/h3-10,21H,1-2H3/b14-9-,21-16?
InChIKey IPOGJLOCODZXKO-AJUKGGFZSA-N
Molecular Weight 398.868 g/mol
SMILES N=C1\C(C(=O)N=C2N1N=C(C(C)C)S2)=C\c1oc(-c2ccc(cc2)Cl)cc1
SPLASH splash10-0a4l-9740000000-9a44a74038aefb095d4e
Synonyms (6Z)-6-[[5-(4-chlorophenyl)-2-furanyl]methylidene]-5-imino-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[[5-(4-chlorophenyl)-2-furyl]methylene]-5-imino-2-isopropyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one (6Z)-6-[[5-(4-chlorophenyl)furan-2-yl]methylidene]-5-imino-2-propan-2-yl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Wiley ID 1453815