N-[1-azanyl-1-(2-chloranyl-9-cyclopentyl-purin-6-yl)ethyl]-2-chloranyl-benzamide

Systemtic Name: N-[1-azanyl-1-(2-chloranyl-9-cyclopentyl-purin-6-yl)ethyl]-2-chloranyl-benzamide Openeye Name: N-[1-amino-1-(2-chloro-9-cyclopentyl-purin-6-yl)ethyl]-2-chloro-benzamide CAS Name: N-[1-amino-1-(2-chloro-9-cyclopentyl-6-purinyl)ethyl]-2-chlorobenzamide IUPAC Name: N-[1-amino-1-(2-chloro-9-cyclopentylpurin-6-yl)ethyl]-2-chlorobenzamide Traditional Name: N-[1-amino-1-(2-chloro-9-cyclopentyl-purin-6-yl)ethyl]-2-chloro-benzamide Formula: C19H20Cl2N6O MolecularWeight: 419.3077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C(=NC(=N1)Cl)N(C=N2)C3CCCC3)(N)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CC(C1=C2C(=NC(=N1)Cl)N(C=N2)C3CCCC3)(N)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C19H20Cl2N6O/c1-19(22,26-17(28)12-8-4-5-9-13(12)20)15-14-16(25-18(21)24-15)27(10-23-14)11-6-2-3-7-11/h4-5,8-11H,2-3,6-7,22H2,1H3,(H,26,28)