2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide

Systemtic Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxidanylidene-pteridin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide Openeye Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxo-pteridin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide CAS Name: 2-[[3-[(2-chlorophenyl)methyl]-4-oxo-2-pteridinyl]thio]-N-(4-fluorophenyl)butanamide IUPAC Name: 2-[3-[(2-chlorophenyl)methyl]-4-oxopteridin-2-yl]sulfanyl-N-(4-fluorophenyl)butanamide Traditional Name: 2-[[3-(2-chlorobenzyl)-4-keto-pteridin-2-yl]thio]-N-(4-fluorophenyl)butyramide Formula: C23H19ClFN5O2S MolecularWeight: 483.945663

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4Cl

InChI

InChI=1S/C23H19ClFN5O2S/c1-2-18(21(31)28-16-9-7-15(25)8-10-16)33-23-29-20-19(26-11-12-27-20)22(32)30(23)13-14-5-3-4-6-17(14)24/h3-12,18H,2,13H2,1H3,(H,28,31)