2-[3-[(4-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(2-fluorophenyl)ethanamide

Systemtic Name: 2-[3-[(4-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(2-fluorophenyl)ethanamide Openeye Name: 2-[3-[(4-chlorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-N-(2-fluorophenyl)acetamide CAS Name: 2-[[3-[(4-chlorophenyl)methyl]-4-oxo-2-pteridinyl]thio]-N-(2-fluorophenyl)acetamide IUPAC Name: 2-[3-[(4-chlorophenyl)methyl]-4-oxopteridin-2-yl]sulfanyl-N-(2-fluorophenyl)acetamide Traditional Name: 2-[[3-(4-chlorobenzyl)-4-keto-pteridin-2-yl]thio]-N-(2-fluorophenyl)acetamide Formula: C21H15ClFN5O2S MolecularWeight: 455.892503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)Cl)F

InChI

InChI=1S/C21H15ClFN5O2S/c22-14-7-5-13(6-8-14)11-28-20(30)18-19(25-10-9-24-18)27-21(28)31-12-17(29)26-16-4-2-1-3-15(16)23/h1-10H,11-12H2,(H,26,29)