6-[(E)-(phenylhydrazinylidene)methyl]-2-(phenylmethylsulfanyl)-1H-pteridin-4-one

Systemtic Name: 6-[(E)-(phenylhydrazinylidene)methyl]-2-(phenylmethylsulfanyl)-1H-pteridin-4-one Openeye Name: 2-benzylsulfanyl-6-[(E)-(phenylhydrazono)methyl]-1H-pteridin-4-one CAS Name: 6-[(E)-(phenylhydrazinylidene)methyl]-2-(phenylmethylthio)-1H-pteridin-4-one IUPAC Name: 2-benzylsulfanyl-6-[(E)-(phenylhydrazinylidene)methyl]-1H-pteridin-4-one Traditional Name: 2-(benzylthio)-6-[(E)-(phenylhydrazono)methyl]-1H-pteridin-4-one Formula: C20H16N6OS MolecularWeight: 388.44564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)C3=NC(=CN=C3N2)C=NNC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)C3=NC(=CN=C3N2)/C=N/NC4=CC=CC=C4

InChI

InChI=1S/C20H16N6OS/c27-19-17-18(24-20(25-19)28-13-14-7-3-1-4-8-14)21-11-16(23-17)12-22-26-15-9-5-2-6-10-15/h1-12,26H,13H2,(H,21,24,25,27)/b22-12+