N-(5-chloranyl-2-methoxy-phenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-acetamide CAS Name: N-(5-chloro-2-methoxyphenyl)-2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-pteridinyl]thio]acetamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-2-[3-[(4-fluorophenyl)methyl]-4-oxopteridin-2-yl]sulfanylacetamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-2-[[3-(4-fluorobenzyl)-4-keto-pteridin-2-yl]thio]acetamide Formula: C22H17ClFN5O3S MolecularWeight: 485.918483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClFN5O3S/c1-32-17-7-4-14(23)10-16(17)27-18(30)12-33-22-28-20-19(25-8-9-26-20)21(31)29(22)11-13-2-5-15(24)6-3-13/h2-10H,11-12H2,1H3,(H,27,30)