6-(4-chlorophenyl)-8-[(4-fluorophenyl)methyl]-2-piperazin-1-yl-pteridin-7-one

Systemtic Name: 6-(4-chlorophenyl)-8-[(4-fluorophenyl)methyl]-2-piperazin-1-yl-pteridin-7-one Openeye Name: 6-(4-chlorophenyl)-8-[(4-fluorophenyl)methyl]-2-piperazin-1-yl-pteridin-7-one CAS Name: 6-(4-chlorophenyl)-8-[(4-fluorophenyl)methyl]-2-(1-piperazinyl)-7-pteridinone IUPAC Name: 6-(4-chlorophenyl)-8-[(4-fluorophenyl)methyl]-2-piperazin-1-ylpteridin-7-one Traditional Name: 6-(4-chlorophenyl)-8-(4-fluorobenzyl)-2-piperazino-pteridin-7-one Formula: C23H20ClFN6O MolecularWeight: 450.895903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=C(C=C4)Cl)CC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=C(C=C4)Cl)CC5=CC=C(C=C5)F

InChI

InChI=1S/C23H20ClFN6O/c24-17-5-3-16(4-6-17)20-22(32)31(14-15-1-7-18(25)8-2-15)21-19(28-20)13-27-23(29-21)30-11-9-26-10-12-30/h1-8,13,26H,9-12,14H2