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

Systemtic Name: N-(4-fluorophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-fluorophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(4-fluorophenyl)-2-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-pteridinyl]thio]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[3-[(4-methoxyphenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetamide Traditional Name: N-(4-fluorophenyl)-2-[(4-keto-3-p-anisyl-pteridin-2-yl)thio]acetamide Formula: C22H18FN5O3S MolecularWeight: 451.473423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C22H18FN5O3S/c1-31-17-8-2-14(3-9-17)12-28-21(30)19-20(25-11-10-24-19)27-22(28)32-13-18(29)26-16-6-4-15(23)5-7-16/h2-11H,12-13H2,1H3,(H,26,29)