2-bromanyl-N-[4-[(6-oxidanylidene-7H-purin-1-yl)methyl]phenyl]ethanamide

Systemtic Name: 2-bromanyl-N-[4-[(6-oxidanylidene-7H-purin-1-yl)methyl]phenyl]ethanamide Openeye Name: 2-bromo-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]acetamide CAS Name: 2-bromo-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]acetamide IUPAC Name: 2-bromo-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]acetamide Traditional Name: 2-bromo-N-[4-[(6-keto-7H-purin-1-yl)methyl]phenyl]acetamide Formula: C14H12BrN5O2 MolecularWeight: 362.18138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)NC(=O)CBr

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)NC(=O)CBr

InChI

InChI=1S/C14H12BrN5O2/c15-5-11(21)19-10-3-1-9(2-4-10)6-20-8-18-13-12(14(20)22)16-7-17-13/h1-4,7-8H,5-6H2,(H,16,17)(H,19,21)