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

Systemtic Name: 2-azanyl-9-[3-(methylsulfonimidoyl)propyl]-3H-purin-6-one Openeye Name: 2-amino-9-[3-(methylsulfonimidoyl)propyl]-3H-purin-6-one CAS Name: 2-amino-9-[3-(methylsulfonimidoyl)propyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[3-(methylsulfonimidoyl)propyl]-3H-purin-6-one Traditional Name: 2-amino-9-[3-(methylsulfonimidoyl)propyl]-3H-purin-6-one Formula: C9H14N6O2S MolecularWeight: 270.31146

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Descriptors Computed from Structure

Canonical SMILES:

CS(=N)(=O)CCCN1C=NC2=C1NC(=NC2=O)N

Isomeric SMILES

CS(=N)(=O)CCCN1C=NC2=C1NC(=NC2=O)N

InChI

InChI=1S/C9H14N6O2S/c1-18(11,17)4-2-3-15-5-12-6-7(15)13-9(10)14-8(6)16/h5,11H,2-4H2,1H3,(H3,10,13,14,16)