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2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-8H-pteridin-7-one

2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-8H-pteridin-7-one

Systemtic Name:2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-8H-pteridin-7-one
Openeye Name:2-[(2,3-difluorophenyl)methylsulfanyl]-8H-pteridin-7-one
CAS Name:2-[(2,3-difluorophenyl)methylthio]-8H-pteridin-7-one
IUPAC Name:2-[(2,3-difluorophenyl)methylsulfanyl]-8H-pteridin-7-one
Traditional Name:2-[(2,3-difluorobenzyl)thio]-8H-pteridin-7-one
Formula: C13H8F2N4OS
MolecularWeight: 306.290626
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)CSC2=NC=C3C(=N2)NC(=O)C=N3


Isomeric SMILES

C1=CC(=C(C(=C1)F)F)CSC2=NC=C3C(=N2)NC(=O)C=N3


InChI

InChI=1S/C13H8F2N4OS/c14-8-3-1-2-7(11(8)15)6-21-13-17-4-9-12(19-13)18-10(20)5-16-9/h1-5H,6H2,(H,17,18,19,20)


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