sulfuric acid; 4-[2,4,7-tris(azanyl)-5H-pteridin-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: sulfuric acid; 4-[2,4,7-tris(azanyl)-5H-pteridin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: sulfuric acid; 4-(2,4,7-triamino-5H-pteridin-6-ylidene)cyclohexa-2,5-dien-1-one CAS Name: sulfuric acid; 4-(2,4,7-triamino-5H-pteridin-6-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: sulfuric acid; 4-(2,4,7-triamino-5H-pteridin-6-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: sulfuric acid; 4-(2,4,7-triamino-5H-pteridin-6-ylidene)cyclohexa-2,5-dien-1-one Formula: C12H13N7O5S MolecularWeight: 367.34052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2C(=NC3=C(N2)C(=NC(=N3)N)N)N.OS(=O)(=O)O

Isomeric SMILES

C1=CC(=O)C=CC1=C2C(=NC3=C(N2)C(=NC(=N3)N)N)N.OS(=O)(=O)O

InChI

InChI=1S/C12H11N7O.H2O4S/c13-9-7(5-1-3-6(20)4-2-5)16-8-10(14)18-12(15)19-11(8)17-9;1-5(2,3)4/h1-4,16H,(H6,13,14,15,17,18,19);(H2,1,2,3,4)