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

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(2-methylphenyl)ethanamide Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-N-(o-tolyl)acetamide CAS Name: 2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-pteridinyl]thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxopteridin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide Traditional Name: 2-[[3-(4-fluorobenzyl)-4-keto-pteridin-2-yl]thio]-N-(o-tolyl)acetamide Formula: C22H18FN5O2S MolecularWeight: 435.474023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN5O2S/c1-14-4-2-3-5-17(14)26-18(29)13-31-22-27-20-19(24-10-11-25-20)21(30)28(22)12-15-6-8-16(23)9-7-15/h2-11H,12-13H2,1H3,(H,26,29)