3-chloranyl-N-[2-[(2-chloranyl-9-cyclopentyl-purin-6-yl)amino]ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[(2-chloranyl-9-cyclopentyl-purin-6-yl)amino]ethyl]benzamide Openeye Name: 3-chloro-N-[2-[(2-chloro-9-cyclopentyl-purin-6-yl)amino]ethyl]benzamide CAS Name: 3-chloro-N-[2-[(2-chloro-9-cyclopentyl-6-purinyl)amino]ethyl]benzamide IUPAC Name: 3-chloro-N-[2-[(2-chloro-9-cyclopentylpurin-6-yl)amino]ethyl]benzamide Traditional Name: 3-chloro-N-[2-[(2-chloro-9-cyclopentyl-purin-6-yl)amino]ethyl]benzamide Formula: C19H20Cl2N6O MolecularWeight: 419.3077

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCNC(=O)C4=CC(=CC=C4)Cl)Cl

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3NCCNC(=O)C4=CC(=CC=C4)Cl)Cl

InChI

InChI=1S/C19H20Cl2N6O/c20-13-5-3-4-12(10-13)18(28)23-9-8-22-16-15-17(26-19(21)25-16)27(11-24-15)14-6-1-2-7-14/h3-5,10-11,14H,1-2,6-9H2,(H,23,28)(H,22,25,26)