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

Systemtic Name: 2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-methyl-pteridin-4-one Openeye Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methyl-pteridin-4-one CAS Name: 2-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methylthio]-3-methyl-4-pteridinone IUPAC Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methylpteridin-4-one Traditional Name: 2-[[4-(4-chlorobenzoyl)benzyl]thio]-3-methyl-pteridin-4-one Formula: C21H15ClN4O2S MolecularWeight: 422.8874

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=NC=CN=C2N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=NC=CN=C2N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O2S/c1-26-20(28)17-19(24-11-10-23-17)25-21(26)29-12-13-2-4-14(5-3-13)18(27)15-6-8-16(22)9-7-15/h2-11H,12H2,1H3