3-chloranyl-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide Openeye Name: 3-chloro-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide CAS Name: 3-chloro-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide IUPAC Name: 3-chloro-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide Traditional Name: 3-chloro-4-methyl-N-(7H-purin-6-yl)benzenesulfonamide Formula: C12H10ClN5O2S MolecularWeight: 323.7581

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=NC=NC3=C2NC=N3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=NC=NC3=C2NC=N3)Cl

InChI

InChI=1S/C12H10ClN5O2S/c1-7-2-3-8(4-9(7)13)21(19,20)18-12-10-11(15-5-14-10)16-6-17-12/h2-6H,1H3,(H2,14,15,16,17,18)