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

Systemtic Name: N-(3,4-dimethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3,4-dimethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(3,4-dimethylphenyl)-2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetamide Traditional Name: N-(3,4-dimethylphenyl)-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:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=C(C=C4)F)C

InChI

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