4-[(6-chloranylpurin-9-yl)methyl]benzenesulfonamide

Systemtic Name: 4-[(6-chloranylpurin-9-yl)methyl]benzenesulfonamide Openeye Name: 4-[(6-chloropurin-9-yl)methyl]benzenesulfonamide CAS Name: 4-[(6-chloro-9-purinyl)methyl]benzenesulfonamide IUPAC Name: 4-[(6-chloropurin-9-yl)methyl]benzenesulfonamide Traditional Name: 4-[(6-chloropurin-9-yl)methyl]benzenesulfonamide Formula: C12H10ClN5O2S MolecularWeight: 323.7581

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C2N=CN=C3Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C2N=CN=C3Cl)S(=O)(=O)N

InChI

InChI=1S/C12H10ClN5O2S/c13-11-10-12(16-6-15-11)18(7-17-10)5-8-1-3-9(4-2-8)21(14,19)20/h1-4,6-7H,5H2,(H2,14,19,20)