N-(3,5-dimethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(3,5-dimethoxyphenyl)-2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[[3-(4-fluorobenzyl)-4-keto-pteridin-2-yl]thio]acetamide Formula: C23H20FN5O4S MolecularWeight: 481.499403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F)OC

InChI

InChI=1S/C23H20FN5O4S/c1-32-17-9-16(10-18(11-17)33-2)27-19(30)13-34-23-28-21-20(25-7-8-26-21)22(31)29(23)12-14-3-5-15(24)6-4-14/h3-11H,12-13H2,1-2H3,(H,27,30)