5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3,3-dimethyl-pentane-1-sulfonamide

Systemtic Name: 5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3,3-dimethyl-pentane-1-sulfonamide Openeye Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-3,3-dimethyl-pentane-1-sulfonamide CAS Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-3,3-dimethyl-1-pentanesulfonamide IUPAC Name: 5-(2-amino-6-oxo-3H-purin-9-yl)-3,3-dimethylpentane-1-sulfonamide Traditional Name: 5-(2-amino-6-keto-3H-purin-9-yl)-3,3-dimethyl-pentane-1-sulfonamide Formula: C12H20N6O3S MolecularWeight: 328.3906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=NC2=C1NC(=NC2=O)N)CCS(=O)(=O)N

Isomeric SMILES

CC(C)(CCN1C=NC2=C1NC(=NC2=O)N)CCS(=O)(=O)N

InChI

InChI=1S/C12H20N6O3S/c1-12(2,4-6-22(14,20)21)3-5-18-7-15-8-9(18)16-11(13)17-10(8)19/h7H,3-6H2,1-2H3,(H2,14,20,21)(H3,13,16,17,19)