3-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one

Systemtic Name: 3-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one Openeye Name: 3-[(4-chlorophenyl)methyl]-2-(p-tolylmethylsulfanyl)pteridin-4-one CAS Name: 3-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)methylthio]-4-pteridinone IUPAC Name: 3-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one Traditional Name: 3-(4-chlorobenzyl)-2-[(4-methylbenzyl)thio]pteridin-4-one Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN4OS/c1-14-2-4-16(5-3-14)13-28-21-25-19-18(23-10-11-24-19)20(27)26(21)12-15-6-8-17(22)9-7-15/h2-11H,12-13H2,1H3