2-azanyl-6-(phenylmethylsulfanyl)-1H-pteridin-4-one

Systemtic Name: 2-azanyl-6-(phenylmethylsulfanyl)-1H-pteridin-4-one Openeye Name: 2-amino-6-benzylsulfanyl-1H-pteridin-4-one CAS Name: 2-amino-6-(phenylmethylthio)-1H-pteridin-4-one IUPAC Name: 2-amino-6-benzylsulfanyl-1H-pteridin-4-one Traditional Name: 2-amino-6-(benzylthio)-1H-pteridin-4-one Formula: C13H11N5OS MolecularWeight: 285.32434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=CN=C3C(=N2)C(=O)N=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=CN=C3C(=N2)C(=O)N=C(N3)N

InChI

InChI=1S/C13H11N5OS/c14-13-17-11-10(12(19)18-13)16-9(6-15-11)20-7-8-4-2-1-3-5-8/h1-6H,7H2,(H3,14,15,17,18,19)