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2-Mercapto-3-Phenylamino-3H-Quinazolin-4-One
[CAS# 5958-14-5]

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Identification
Name 2-Mercapto-3-Phenylamino-3H-Quinazolin-4-One
Synonyms 3-(Phenylamino)-2-Thioxo-1H-Quinazolin-4-One; Zinc00618780; T5380575
Molecular Structure CAS#: 5958-14-5, 2-Mercapto-3-Phenylamino-3H-Quinazolin-4-One
Molecular Formula C14H11N3OS
Molecular Weight 269.32
CAS Registry Number 5958-14-5
SMILES C1=CC=CC3=C1C(N(NC2=CC=CC=C2)C(N3)=S)=O
InChI 1S/C14H11N3OS/c18-13-11-8-4-5-9-12(11)15-14(19)17(13)16-10-6-2-1-3-7-10/h1-9,16H,(H,15,19)
InChIKey KJWKTRKFHNLVFD-UHFFFAOYSA-N
Properties
Density 1.432g/cm3 (Cal.)
Boiling point 430.777°C at 760 mmHg (Cal.)
Flash point 214.326°C (Cal.)
Market Analysis Reports
List of Reports Available for 2-Mercapto-3-Phenylamino-3H-Quinazolin-4-One
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