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

Systemtic Name: N-(4-ethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-ethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(4-ethylphenyl)-2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetamide Traditional Name: N-(4-ethylphenyl)-2-[[3-(4-fluorobenzyl)-4-keto-pteridin-2-yl]thio]acetamide Formula: C23H20FN5O2S MolecularWeight: 449.500603

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN5O2S/c1-2-15-5-9-18(10-6-15)27-19(30)14-32-23-28-21-20(25-11-12-26-21)22(31)29(23)13-16-3-7-17(24)8-4-16/h3-12H,2,13-14H2,1H3,(H,27,30)