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

Systemtic Name: 4-[(2-chloranyl-7H-purin-6-yl)amino]-N-(pyridin-2-ylmethyl)butanamide Openeye Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-(2-pyridylmethyl)butanamide CAS Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-(2-pyridinylmethyl)butanamide IUPAC Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-(pyridin-2-ylmethyl)butanamide Traditional Name: 4-[(2-chloro-7H-purin-6-yl)amino]-N-(2-pyridylmethyl)butyramide Formula: C15H16ClN7O MolecularWeight: 345.78684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)CCCNC2=NC(=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)CCCNC2=NC(=NC3=C2NC=N3)Cl

InChI

InChI=1S/C15H16ClN7O/c16-15-22-13(12-14(23-15)21-9-20-12)18-7-3-5-11(24)19-8-10-4-1-2-6-17-10/h1-2,4,6,9H,3,5,7-8H2,(H,19,24)(H2,18,20,21,22,23)