5-phenyl-6-(3-pyridin-2-ylphenyl)-2H-1,2,4-triazine-1-sulfonic acid

Systemtic Name: 5-phenyl-6-(3-pyridin-2-ylphenyl)-2H-1,2,4-triazine-1-sulfonic acid Openeye Name: 5-phenyl-6-[3-(2-pyridyl)phenyl]-2H-1,2,4-triazine-1-sulfonic acid CAS Name: 5-phenyl-6-[3-(2-pyridinyl)phenyl]-2H-1,2,4-triazine-1-sulfonic acid IUPAC Name: 5-phenyl-6-(3-pyridin-2-ylphenyl)-2H-1,2,4-triazine-1-sulfonic acid Traditional Name: 5-phenyl-6-[3-(2-pyridyl)phenyl]-2H-1,2,4-triazine-1-sulfonic acid Formula: C20H16N4O3S MolecularWeight: 392.43104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(NC=N2)S(=O)(=O)O)C3=CC=CC(=C3)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(NC=N2)S(=O)(=O)O)C3=CC=CC(=C3)C4=CC=CC=N4

InChI

InChI=1S/C20H16N4O3S/c25-28(26,27)24-20(19(22-14-23-24)15-7-2-1-3-8-15)17-10-6-9-16(13-17)18-11-4-5-12-21-18/h1-14H,(H,22,23)(H,25,26,27)