2-azanyl-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one CAS Name: 2-amino-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[5-(methylsulfonimidoyl)pentyl]-3H-purin-6-one Formula: C11H18N6O2S MolecularWeight: 298.36462

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Descriptors Computed from Structure

Canonical SMILES:

CS(=N)(=O)CCCCCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CS(=N)(=O)CCCCCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C11H18N6O2S/c1-20(13,19)6-4-2-3-5-17-7-14-8-9(17)15-11(12)16-10(8)18/h7,13H,2-6H2,1H3,(H3,12,15,16,18)