N-(2-aminophenyl)-4-[[(2-chloranyl-7H-purin-6-yl)amino]methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[[(2-chloranyl-7H-purin-6-yl)amino]methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[[(2-chloro-7H-purin-6-yl)amino]methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[[(2-chloro-7H-purin-6-yl)amino]methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[[(2-chloro-7H-purin-6-yl)amino]methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[[(2-chloro-7H-purin-6-yl)amino]methyl]benzamide Formula: C19H16ClN7O MolecularWeight: 393.82964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC3=NC(=NC4=C3NC=N4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC3=NC(=NC4=C3NC=N4)Cl

InChI

InChI=1S/C19H16ClN7O/c20-19-26-16(15-17(27-19)24-10-23-15)22-9-11-5-7-12(8-6-11)18(28)25-14-4-2-1-3-13(14)21/h1-8,10H,9,21H2,(H,25,28)(H2,22,23,24,26,27)