4-chloranyl-N-(7H-purin-6-ylcarbamoyl)benzamide

Systemtic Name: 4-chloranyl-N-(7H-purin-6-ylcarbamoyl)benzamide Openeye Name: 4-chloro-N-(7H-purin-6-ylcarbamoyl)benzamide CAS Name: 4-chloro-N-[oxo-(7H-purin-6-ylamino)methyl]benzamide IUPAC Name: 4-chloro-N-(7H-purin-6-ylcarbamoyl)benzamide Traditional Name: 4-chloro-N-(7H-purin-6-ylcarbamoyl)benzamide Formula: C13H9ClN6O2 MolecularWeight: 316.70256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC(=O)NC2=NC=NC3=C2NC=N3)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC(=O)NC2=NC=NC3=C2NC=N3)Cl

InChI

InChI=1S/C13H9ClN6O2/c14-8-3-1-7(2-4-8)12(21)20-13(22)19-11-9-10(16-5-15-9)17-6-18-11/h1-6H,(H3,15,16,17,18,19,20,21,22)