N-butyl-4-[(2-chloranyl-9-ethyl-purin-6-yl)amino]benzenesulfonamide

Systemtic Name: N-butyl-4-[(2-chloranyl-9-ethyl-purin-6-yl)amino]benzenesulfonamide Openeye Name: N-butyl-4-[(2-chloro-9-ethyl-purin-6-yl)amino]benzenesulfonamide CAS Name: N-butyl-4-[(2-chloro-9-ethyl-6-purinyl)amino]benzenesulfonamide IUPAC Name: N-butyl-4-[(2-chloro-9-ethylpurin-6-yl)amino]benzenesulfonamide Traditional Name: N-butyl-4-[(2-chloro-9-ethyl-purin-6-yl)amino]benzenesulfonamide Formula: C17H21ClN6O2S MolecularWeight: 408.90564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC)Cl

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC)Cl

InChI

InChI=1S/C17H21ClN6O2S/c1-3-5-10-20-27(25,26)13-8-6-12(7-9-13)21-15-14-16(23-17(18)22-15)24(4-2)11-19-14/h6-9,11,20H,3-5,10H2,1-2H3,(H,21,22,23)