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4-Chloro-N-[2-(ethoxymethyl)-7-oxo-7H-pyrimido[2,1-b][1,3,4]thiadiazol-6-yl]benzamide
SpectraBase Compound ID B3fmlrp33JI
InChI InChI=1S/C15H13ClN4O3S/c1-2-23-8-12-19-20-14(22)11(7-17-15(20)24-12)18-13(21)9-3-5-10(16)6-4-9/h3-7H,2,8H2,1H3,(H,18,21)
InChIKey BWQJWXKRKQLVRO-UHFFFAOYSA-N
Mol Weight 364.81 g/mol
Molecular Formula C15H13ClN4O3S
Exact Mass 364.039689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cvVKFZUuCq
Name 4-Chloro-N-[2-(ethoxymethyl)-7-oxo-7H-pyrimido[2,1-b][1,3,4]thiadiazol-6-yl]benzamide
Alternate Name(s) Benzamide, 4-chloro-N-[2-(ethoxymethyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]- 4-Chloro-N-[2-(ethoxymethyl)-5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]benzamide 4-Chloranyl-N-[2-(ethoxymethyl)-5-oxidanylidene-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]benzamide
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Formula C15H13ClN4O3S
InChI InChI=1S/C15H13ClN4O3S/c1-2-23-8-12-19-20-14(22)11(7-17-15(20)24-12)18-13(21)9-3-5-10(16)6-4-9/h3-7H,2,8H2,1H3,(H,18,21)
InChIKey BWQJWXKRKQLVRO-UHFFFAOYSA-N
Molecular Weight 364.807 g/mol
SMILES N(C=1C(N2C(SC(=N2)COCC)=NC1)=O)C(c1ccc(cc1)Cl)=O
SPLASH splash10-01p9-2903000000-bec3a55f52702cc021f5
Source of Spectrum IY-2-5002-2
Wiley ID 1658005