4-chloranyl-N-[4-[(6-oxidanylidene-7H-purin-1-yl)methyl]phenyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[(6-oxidanylidene-7H-purin-1-yl)methyl]phenyl]benzamide Openeye Name: 4-chloro-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]benzamide CAS Name: 4-chloro-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]benzamide IUPAC Name: 4-chloro-N-[4-[(6-oxo-7H-purin-1-yl)methyl]phenyl]benzamide Traditional Name: 4-chloro-N-[4-[(6-keto-7H-purin-1-yl)methyl]phenyl]benzamide Formula: C19H14ClN5O2 MolecularWeight: 379.79976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)NC=N3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H14ClN5O2/c20-14-5-3-13(4-6-14)18(26)24-15-7-1-12(2-8-15)9-25-11-23-17-16(19(25)27)21-10-22-17/h1-8,10-11H,9H2,(H,21,22)(H,24,26)