N-[(2-chlorophenyl)methyl]-3-(7H-purin-6-ylamino)propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-(7H-purin-6-ylamino)propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-3-(7H-purin-6-ylamino)propanamide CAS Name: N-[(2-chlorophenyl)methyl]-3-(7H-purin-6-ylamino)propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3-(7H-purin-6-ylamino)propanamide Traditional Name: N-(2-chlorobenzyl)-3-(7H-purin-6-ylamino)propionamide Formula: C15H15ClN6O MolecularWeight: 330.7722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCNC2=NC=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCNC2=NC=NC3=C2NC=N3)Cl

InChI

InChI=1S/C15H15ClN6O/c16-11-4-2-1-3-10(11)7-18-12(23)5-6-17-14-13-15(20-8-19-13)22-9-21-14/h1-4,8-9H,5-7H2,(H,18,23)(H2,17,19,20,21,22)