1,3-dimethyl-7-phenyl-5H-purino[8,9-b][1,3]thiazol-9-ium-2,4-dione

Systemtic Name: 1,3-dimethyl-7-phenyl-5H-purino[8,9-b][1,3]thiazol-9-ium-2,4-dione Openeye Name: 1,3-dimethyl-7-phenyl-5H-purino[8,9-b]thiazol-9-ium-2,4-dione CAS Name: 1,3-dimethyl-7-phenyl-5H-purino[8,9-b]thiazol-9-ium-2,4-dione IUPAC Name: 1,3-dimethyl-7-phenyl-5H-purino[8,9-b][1,3]thiazol-9-ium-2,4-dione Traditional Name: 1,3-dimethyl-7-phenyl-5H-purino[8,9-b]thiazol-9-ium-2,4-quinone Formula: C15H13N4O2S+ MolecularWeight: 313.35432

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC3=[N+]2C=C(S3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC3=[N+]2C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C15H12N4O2S/c1-17-12-11(13(20)18(2)15(17)21)16-14-19(12)8-10(22-14)9-6-4-3-5-7-9/h3-8H,1-2H3/p+1