1,3-dimethyl-6-phenyl-7-sulfanylidene-8H-pteridine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-phenyl-7-sulfanylidene-8H-pteridine-2,4-dione Openeye Name: 1,3-dimethyl-6-phenyl-7-thioxo-8H-pteridine-2,4-dione CAS Name: 1,3-dimethyl-6-phenyl-7-sulfanylidene-8H-pteridine-2,4-dione IUPAC Name: 1,3-dimethyl-6-phenyl-7-sulfanylidene-8H-pteridine-2,4-dione Traditional Name: 1,3-dimethyl-6-phenyl-7-thioxo-8H-pteridine-2,4-quinone Formula: C14H12N4O2S MolecularWeight: 300.33568

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=C(C(=S)N2)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=C(C(=S)N2)C3=CC=CC=C3

InChI

InChI=1S/C14H12N4O2S/c1-17-11-10(13(19)18(2)14(17)20)15-9(12(21)16-11)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,16,21)