1-(7-oxidanyl-8-phenyl-[1,3]thiazolo[2,3-f]purin-6-ium-1-yl)ethanone

Systemtic Name: 1-(7-oxidanyl-8-phenyl-[1,3]thiazolo[2,3-f]purin-6-ium-1-yl)ethanone Openeye Name: 1-(7-hydroxy-8-phenyl-thiazolo[2,3-f]purin-6-ium-1-yl)ethanone CAS Name: 1-(7-hydroxy-8-phenyl-1-thiazolo[2,3-f]purin-6-iumyl)ethanone IUPAC Name: 1-(7-hydroxy-8-phenyl-[1,3]thiazolo[2,3-f]purin-6-ium-1-yl)ethanone Traditional Name: 1-(7-hydroxy-8-phenyl-thiazolo[2,3-f]purin-6-ium-1-yl)ethanone Formula: C15H11N4O2S+ MolecularWeight: 311.33844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=NC2=C1C3=[N+](C=N2)C(=C(S3)C4=CC=CC=C4)O

Isomeric SMILES

CC(=O)N1C=NC2=C1C3=[N+](C=N2)C(=C(S3)C4=CC=CC=C4)O

InChI

InChI=1S/C15H10N4O2S/c1-9(20)18-7-16-13-11(18)15-19(8-17-13)14(21)12(22-15)10-5-3-2-4-6-10/h2-8H,1H3/p+1