4-[3-fluoranyl-4-[7-(4-methoxyphenyl)-6-oxidanylidene-purin-1-yl]phenyl]pyridine-3-sulfonamide

Systemtic Name: 4-[3-fluoranyl-4-[7-(4-methoxyphenyl)-6-oxidanylidene-purin-1-yl]phenyl]pyridine-3-sulfonamide Openeye Name: 4-[3-fluoro-4-[7-(4-methoxyphenyl)-6-oxo-purin-1-yl]phenyl]pyridine-3-sulfonamide CAS Name: 4-[3-fluoro-4-[7-(4-methoxyphenyl)-6-oxo-1-purinyl]phenyl]-3-pyridinesulfonamide IUPAC Name: 4-[3-fluoro-4-[7-(4-methoxyphenyl)-6-oxopurin-1-yl]phenyl]pyridine-3-sulfonamide Traditional Name: 4-[3-fluoro-4-[6-keto-7-(4-methoxyphenyl)purin-1-yl]phenyl]pyridine-3-sulfonamide Formula: C23H17FN6O4S MolecularWeight: 492.482283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=NC3=C2C(=O)N(C=N3)C4=C(C=C(C=C4)C5=C(C=NC=C5)S(=O)(=O)N)F

Isomeric SMILES

COC1=CC=C(C=C1)N2C=NC3=C2C(=O)N(C=N3)C4=C(C=C(C=C4)C5=C(C=NC=C5)S(=O)(=O)N)F

InChI

InChI=1S/C23H17FN6O4S/c1-34-16-5-3-15(4-6-16)29-12-27-22-21(29)23(31)30(13-28-22)19-7-2-14(10-18(19)24)17-8-9-26-11-20(17)35(25,32)33/h2-13H,1H3,(H2,25,32,33)