4-methyl-N-purin-9-id-6-yl-benzenesulfonamide

Systemtic Name: 4-methyl-N-purin-9-id-6-yl-benzenesulfonamide Openeye Name: 4-methyl-N-purin-9-id-6-yl-benzenesulfonamide CAS Name: 4-methyl-N-(6-purin-9-idyl)benzenesulfonamide IUPAC Name: 4-methyl-N-purin-9-id-6-ylbenzenesulfonamide Traditional Name: 4-methyl-N-purin-9-id-6-yl-benzenesulfonamide Formula: C12H10N5O2S- MolecularWeight: 288.3051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=NC3=C2N=C[N-]3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC=NC3=C2N=C[N-]3

InChI

InChI=1S/C12H10N5O2S/c1-8-2-4-9(5-3-8)20(18,19)17-12-10-11(14-6-13-10)15-7-16-12/h2-7H,1H3,(H-,13,14,15,16,17)/q-1