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

Systemtic Name: 8-[(4-chloranyl-2-fluoranyl-phenyl)methyl]-5-methyl-2-[4-(2-pyrrolidin-1-ylethyl)phenyl]-7H-pteridin-6-one Openeye Name: 8-[(4-chloro-2-fluoro-phenyl)methyl]-5-methyl-2-[4-(2-pyrrolidin-1-ylethyl)phenyl]-7H-pteridin-6-one CAS Name: 8-[(4-chloro-2-fluorophenyl)methyl]-5-methyl-2-[4-[2-(1-pyrrolidinyl)ethyl]phenyl]-7H-pteridin-6-one IUPAC Name: 8-[(4-chloro-2-fluorophenyl)methyl]-5-methyl-2-[4-(2-pyrrolidin-1-ylethyl)phenyl]-7H-pteridin-6-one Traditional Name: 8-(4-chloro-2-fluoro-benzyl)-5-methyl-2-[4-(2-pyrrolidinoethyl)phenyl]-7H-pteridin-6-one Formula: C26H27ClFN5O MolecularWeight: 479.976883

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN(C2=NC(=NC=C21)C3=CC=C(C=C3)CCN4CCCC4)CC5=C(C=C(C=C5)Cl)F

Isomeric SMILES

CN1C(=O)CN(C2=NC(=NC=C21)C3=CC=C(C=C3)CCN4CCCC4)CC5=C(C=C(C=C5)Cl)F

InChI

InChI=1S/C26H27ClFN5O/c1-31-23-15-29-25(19-6-4-18(5-7-19)10-13-32-11-2-3-12-32)30-26(23)33(17-24(31)34)16-20-8-9-21(27)14-22(20)28/h4-9,14-15H,2-3,10-13,16-17H2,1H3