N-(phenylmethyl)-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide

Systemtic Name: N-(phenylmethyl)-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide Openeye Name: N-benzyl-2-[6-(benzylamino)purin-9-yl]acetamide CAS Name: N-(phenylmethyl)-2-[6-[(phenylmethyl)amino]-9-purinyl]acetamide IUPAC Name: N-benzyl-2-[6-(benzylamino)purin-9-yl]acetamide Traditional Name: N-benzyl-2-[6-(benzylamino)purin-9-yl]acetamide Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3CC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H20N6O/c28-18(22-11-16-7-3-1-4-8-16)13-27-15-26-19-20(24-14-25-21(19)27)23-12-17-9-5-2-6-10-17/h1-10,14-15H,11-13H2,(H,22,28)(H,23,24,25)