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

Systemtic Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-6,7-dimethyl-1H-pteridin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-6,7-dimethyl-1H-pteridin-4-one CAS Name: 2-(1H-benzimidazol-2-ylmethylthio)-6,7-dimethyl-1H-pteridin-4-one IUPAC Name: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-6,7-dimethyl-1H-pteridin-4-one Traditional Name: 2-(1H-benzimidazol-2-ylmethylthio)-6,7-dimethyl-1H-pteridin-4-one Formula: C16H14N6OS MolecularWeight: 338.38696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(NC(=NC2=O)SCC3=NC4=CC=CC=C4N3)N=C1C

Isomeric SMILES

CC1=NC2=C(NC(=NC2=O)SCC3=NC4=CC=CC=C4N3)N=C1C

InChI

InChI=1S/C16H14N6OS/c1-8-9(2)18-14-13(17-8)15(23)22-16(21-14)24-7-12-19-10-5-3-4-6-11(10)20-12/h3-6H,7H2,1-2H3,(H,19,20)(H,18,21,22,23)