6,7-dimethyl-2-(phenylmethylsulfanyl)-1H-pteridin-4-one

Systemtic Name: 6,7-dimethyl-2-(phenylmethylsulfanyl)-1H-pteridin-4-one Openeye Name: 2-benzylsulfanyl-6,7-dimethyl-1H-pteridin-4-one CAS Name: 6,7-dimethyl-2-(phenylmethylthio)-1H-pteridin-4-one IUPAC Name: 2-benzylsulfanyl-6,7-dimethyl-1H-pteridin-4-one Traditional Name: 2-(benzylthio)-6,7-dimethyl-1H-pteridin-4-one Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(NC(=NC2=O)SCC3=CC=CC=C3)N=C1C

Isomeric SMILES

CC1=NC2=C(NC(=NC2=O)SCC3=CC=CC=C3)N=C1C

InChI

InChI=1S/C15H14N4OS/c1-9-10(2)17-13-12(16-9)14(20)19-15(18-13)21-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,17,18,19,20)