3-[(2-chloranyl-7H-purin-6-yl)amino]-N-(pyridin-4-ylmethyl)propanamide

Systemtic Name: 3-[(2-chloranyl-7H-purin-6-yl)amino]-N-(pyridin-4-ylmethyl)propanamide Openeye Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-(4-pyridylmethyl)propanamide CAS Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-(pyridin-4-ylmethyl)propanamide IUPAC Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-(pyridin-4-ylmethyl)propanamide Traditional Name: 3-[(2-chloro-7H-purin-6-yl)amino]-N-(4-pyridylmethyl)propionamide Formula: C14H14ClN7O MolecularWeight: 331.76026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=CN=CC=C1CNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C14H14ClN7O/c15-14-21-12(11-13(22-14)20-8-19-11)17-6-3-10(23)18-7-9-1-4-16-5-2-9/h1-2,4-5,8H,3,6-7H2,(H,18,23)(H2,17,19,20,21,22)