2-[(3-fluorophenyl)methylsulfanyl]-3-[2-(1H-indol-3-yl)ethyl]pteridin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-[2-(1H-indol-3-yl)ethyl]pteridin-4-one Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-[2-(1H-indol-3-yl)ethyl]pteridin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-[2-(1H-indol-3-yl)ethyl]-4-pteridinone IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-[2-(1H-indol-3-yl)ethyl]pteridin-4-one Traditional Name: 2-[(3-fluorobenzyl)thio]-3-[2-(1H-indol-3-yl)ethyl]pteridin-4-one Formula: C23H18FN5OS MolecularWeight: 431.485323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=NC=CN=C4N=C3SCC5=CC(=CC=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=NC=CN=C4N=C3SCC5=CC(=CC=C5)F

InChI

InChI=1S/C23H18FN5OS/c24-17-5-3-4-15(12-17)14-31-23-28-21-20(25-9-10-26-21)22(30)29(23)11-8-16-13-27-19-7-2-1-6-18(16)19/h1-7,9-10,12-13,27H,8,11,14H2