7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid

Systemtic Name: 7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid Openeye Name: 7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid CAS Name: 7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid IUPAC Name: 7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid Traditional Name: 7-cyano-2-phenyl-5H-pyrrolo[3,2-d]pyrimidine-4-sulfonic acid Formula: C13H8N4O3S MolecularWeight: 300.29262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C(=N2)S(=O)(=O)O)NC=C3C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C(=N2)S(=O)(=O)O)NC=C3C#N

InChI

InChI=1S/C13H8N4O3S/c14-6-9-7-15-11-10(9)16-12(8-4-2-1-3-5-8)17-13(11)21(18,19)20/h1-5,7,15H,(H,18,19,20)