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Ampyzine
[CAS# 5214-29-9]

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Identification
Name Ampyzine
Synonyms 4-(Methylthio)-2,7-Di(Phenyl)-8H-Pyrido[3,2-E]Pyrimidin-5-One; Zinc00050242; Cbmicro_014243
Molecular Structure CAS#: 5214-29-9, Ampyzine
Molecular Formula C20H15N3OS
Molecular Weight 345.42
CAS Registry Number 5214-29-9
SMILES C4=C(C1=NC2=C(C(=N1)SC)C(=O)C=C(N2)C3=CC=CC=C3)C=CC=C4
InChI 1S/C20H15N3OS/c1-25-20-17-16(24)12-15(13-8-4-2-5-9-13)21-19(17)22-18(23-20)14-10-6-3-7-11-14/h2-12H,1H3,(H,21,22,23,24)
InChIKey IJRMYBWSAIGXMI-UHFFFAOYSA-N
Properties
Density 1.367g/cm3 (Cal.)
Boiling point 466.22°C at 760 mmHg (Cal.)
Flash point 235.762°C (Cal.)
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