N-[2-(6-aminopurin-9-yl)ethyl]-3-chloranyl-benzamide

Systemtic Name: N-[2-(6-aminopurin-9-yl)ethyl]-3-chloranyl-benzamide Openeye Name: N-[2-(6-aminopurin-9-yl)ethyl]-3-chloro-benzamide CAS Name: N-[2-(6-aminopurin-9-yl)ethyl]-3-chlorobenzamide IUPAC Name: N-[2-(6-aminopurin-9-yl)ethyl]-3-chlorobenzamide Traditional Name: N-(2-adenin-9-ylethyl)-3-chloro-benzamide Formula: C14H13ClN6O MolecularWeight: 316.74562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)NCCN2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)NCCN2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C14H13ClN6O/c15-10-3-1-2-9(6-10)14(22)17-4-5-21-8-20-11-12(16)18-7-19-13(11)21/h1-3,6-8H,4-5H2,(H,17,22)(H2,16,18,19)