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1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one

1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one

Systemtic Name:1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one
Openeye Name:1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one
CAS Name:1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]-6-purinone
IUPAC Name:1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one
Traditional Name:1-(4-chlorophenyl)-9-ethyl-2-[3-(trifluoromethyl)phenyl]purin-6-one
Formula: C20H14ClF3N4O
MolecularWeight: 418.79957
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N(C2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F


Isomeric SMILES

CCN1C=NC2=C1N=C(N(C2=O)C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)C(F)(F)F


InChI

InChI=1S/C20H14ClF3N4O/c1-2-27-11-25-16-18(27)26-17(12-4-3-5-13(10-12)20(22,23)24)28(19(16)29)15-8-6-14(21)7-9-15/h3-11H,2H2,1H3


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