8-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-(4-ethylpiperazin-1-yl)-5-methyl-7H-pteridin-6-one

Systemtic Name: 8-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-2-(4-ethylpiperazin-1-yl)-5-methyl-7H-pteridin-6-one Openeye Name: 8-[(4-chloro-2-fluoro-phenyl)methyl]-2-(4-ethylpiperazin-1-yl)-5-methyl-7H-pteridin-6-one CAS Name: 8-[(4-chloro-2-fluorophenyl)methyl]-2-(4-ethyl-1-piperazinyl)-5-methyl-7H-pteridin-6-one IUPAC Name: 8-[(4-chloro-2-fluorophenyl)methyl]-2-(4-ethylpiperazin-1-yl)-5-methyl-7H-pteridin-6-one Traditional Name: 8-(4-chloro-2-fluoro-benzyl)-2-(4-ethylpiperazino)-5-methyl-7H-pteridin-6-one Formula: C20H24ClFN6O MolecularWeight: 418.895563

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C3C(=N2)N(CC(=O)N3C)CC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C3C(=N2)N(CC(=O)N3C)CC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C20H24ClFN6O/c1-3-26-6-8-27(9-7-26)20-23-11-17-19(24-20)28(13-18(29)25(17)2)12-14-4-5-15(21)10-16(14)22/h4-5,10-11H,3,6-9,12-13H2,1-2H3