6-azanyl-8-oxidanylidene-9-(phenylmethyl)-N-(phenylsulfonyl)-7H-purine-2-carboxamide

Systemtic Name: 6-azanyl-8-oxidanylidene-9-(phenylmethyl)-N-(phenylsulfonyl)-7H-purine-2-carboxamide Openeye Name: 6-amino-N-(benzenesulfonyl)-9-benzyl-8-oxo-7H-purine-2-carboxamide CAS Name: 6-amino-N-(benzenesulfonyl)-8-oxo-9-(phenylmethyl)-7H-purine-2-carboxamide IUPAC Name: 6-amino-N-(benzenesulfonyl)-9-benzyl-8-oxo-7H-purine-2-carboxamide Traditional Name: 6-amino-9-benzyl-N-besyl-8-keto-7H-purine-2-carboxamide Formula: C19H16N6O4S MolecularWeight: 424.43314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)C(=O)NS(=O)(=O)C4=CC=CC=C4)N)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC(=N3)C(=O)NS(=O)(=O)C4=CC=CC=C4)N)NC2=O

InChI

InChI=1S/C19H16N6O4S/c20-15-14-17(25(19(27)21-14)11-12-7-3-1-4-8-12)23-16(22-15)18(26)24-30(28,29)13-9-5-2-6-10-13/h1-10H,11H2,(H,21,27)(H,24,26)(H2,20,22,23)