4-[(2-chloranyl-9-ethyl-purin-6-yl)amino]benzenesulfonyl chloride

Systemtic Name: 4-[(2-chloranyl-9-ethyl-purin-6-yl)amino]benzenesulfonyl chloride Openeye Name: 4-[(2-chloro-9-ethyl-purin-6-yl)amino]benzenesulfonyl chloride CAS Name: 4-[(2-chloro-9-ethyl-6-purinyl)amino]benzenesulfonyl chloride IUPAC Name: 4-[(2-chloro-9-ethylpurin-6-yl)amino]benzenesulfonyl chloride Traditional Name: 4-[(2-chloro-9-ethyl-purin-6-yl)amino]benzenesulfonyl chloride Formula: C13H11Cl2N5O2S MolecularWeight: 372.22974

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)Cl)Cl

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)Cl)Cl

InChI

InChI=1S/C13H11Cl2N5O2S/c1-2-20-7-16-10-11(18-13(14)19-12(10)20)17-8-3-5-9(6-4-8)23(15,21)22/h3-7H,2H2,1H3,(H,17,18,19)