8-cyclopentyl-2-[(4-fluoranyl-3-methyl-phenyl)amino]pteridin-7-one

Systemtic Name: 8-cyclopentyl-2-[(4-fluoranyl-3-methyl-phenyl)amino]pteridin-7-one Openeye Name: 8-cyclopentyl-2-(4-fluoro-3-methyl-anilino)pteridin-7-one CAS Name: 8-cyclopentyl-2-(4-fluoro-3-methylanilino)-7-pteridinone IUPAC Name: 8-cyclopentyl-2-(4-fluoro-3-methylanilino)pteridin-7-one Traditional Name: 8-cyclopentyl-2-(4-fluoro-3-methyl-anilino)pteridin-7-one Formula: C18H18FN5O MolecularWeight: 339.366823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C=N3)C4CCCC4)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=C3C(=N2)N(C(=O)C=N3)C4CCCC4)F

InChI

InChI=1S/C18H18FN5O/c1-11-8-12(6-7-14(11)19)22-18-21-9-15-17(23-18)24(16(25)10-20-15)13-4-2-3-5-13/h6-10,13H,2-5H2,1H3,(H,21,22,23)