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

Systemtic Name: 2-(4-butylpiperazin-1-yl)-8-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-5-methyl-7H-pteridin-6-one Openeye Name: 2-(4-butylpiperazin-1-yl)-8-[(4-chloro-2-fluoro-phenyl)methyl]-5-methyl-7H-pteridin-6-one CAS Name: 2-(4-butyl-1-piperazinyl)-8-[(4-chloro-2-fluorophenyl)methyl]-5-methyl-7H-pteridin-6-one IUPAC Name: 2-(4-butylpiperazin-1-yl)-8-[(4-chloro-2-fluorophenyl)methyl]-5-methyl-7H-pteridin-6-one Traditional Name: 2-(4-butylpiperazino)-8-(4-chloro-2-fluoro-benzyl)-5-methyl-7H-pteridin-6-one Formula: C22H28ClFN6O MolecularWeight: 446.948723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C2=NC=C3C(=N2)N(CC(=O)N3C)CC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

CCCCN1CCN(CC1)C2=NC=C3C(=N2)N(CC(=O)N3C)CC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C22H28ClFN6O/c1-3-4-7-28-8-10-29(11-9-28)22-25-13-19-21(26-22)30(15-20(31)27(19)2)14-16-5-6-17(23)12-18(16)24/h5-6,12-13H,3-4,7-11,14-15H2,1-2H3