N-(4-chloranyl-2-fluoranyl-phenyl)-2-(4-oxidanylidene-3-phenethyl-pteridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-2-(4-oxidanylidene-3-phenethyl-pteridin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-2-(4-oxo-3-phenethyl-pteridin-2-yl)sulfanyl-acetamide CAS Name: N-(4-chloro-2-fluorophenyl)-2-[(4-oxo-3-phenethyl-2-pteridinyl)thio]acetamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-2-(4-oxo-3-phenethylpteridin-2-yl)sulfanylacetamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-2-[(4-keto-3-phenethyl-pteridin-2-yl)thio]acetamide Formula: C22H17ClFN5O2S MolecularWeight: 469.919083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=NC=CN=C3N=C2SCC(=O)NC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=NC=CN=C3N=C2SCC(=O)NC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C22H17ClFN5O2S/c23-15-6-7-17(16(24)12-15)27-18(30)13-32-22-28-20-19(25-9-10-26-20)21(31)29(22)11-8-14-4-2-1-3-5-14/h1-7,9-10,12H,8,11,13H2,(H,27,30)