N-[5-(8-methyl-6-oxidanylidene-purin-2-yl)-2-phenyl-phenyl]sulfonylbenzamide

Systemtic Name: N-[5-(8-methyl-6-oxidanylidene-purin-2-yl)-2-phenyl-phenyl]sulfonylbenzamide Openeye Name: N-[5-(8-methyl-6-oxo-purin-2-yl)-2-phenyl-phenyl]sulfonylbenzamide CAS Name: N-[5-(8-methyl-6-oxo-2-purinyl)-2-phenylphenyl]sulfonylbenzamide IUPAC Name: N-[5-(8-methyl-6-oxopurin-2-yl)-2-phenylphenyl]sulfonylbenzamide Traditional Name: N-[5-(6-keto-8-methyl-purin-2-yl)-2-phenyl-phenyl]sulfonylbenzamide Formula: C25H17N5O4S MolecularWeight: 483.49858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NC(=O)C2=N1)C3=CC(=C(C=C3)C4=CC=CC=C4)S(=O)(=O)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=NC(=NC(=O)C2=N1)C3=CC(=C(C=C3)C4=CC=CC=C4)S(=O)(=O)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C25H17N5O4S/c1-15-26-21-23(27-15)28-22(29-25(21)32)18-12-13-19(16-8-4-2-5-9-16)20(14-18)35(33,34)30-24(31)17-10-6-3-7-11-17/h2-14H,1H3,(H,30,31)