N-(1H-indol-5-ylmethyl)-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide

Systemtic Name: N-(1H-indol-5-ylmethyl)-2-[6-[(phenylmethyl)amino]purin-9-yl]ethanamide Openeye Name: 2-[6-(benzylamino)purin-9-yl]-N-(1H-indol-5-ylmethyl)acetamide CAS Name: N-(1H-indol-5-ylmethyl)-2-[6-[(phenylmethyl)amino]-9-purinyl]acetamide IUPAC Name: 2-[6-(benzylamino)purin-9-yl]-N-(1H-indol-5-ylmethyl)acetamide Traditional Name: 2-[6-(benzylamino)purin-9-yl]-N-(1H-indol-5-ylmethyl)acetamide Formula: C23H21N7O MolecularWeight: 411.45914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3CC(=O)NCC4=CC5=C(C=C4)NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=NC3=C2N=CN3CC(=O)NCC4=CC5=C(C=C4)NC=C5

InChI

InChI=1S/C23H21N7O/c31-20(25-12-17-6-7-19-18(10-17)8-9-24-19)13-30-15-29-21-22(27-14-28-23(21)30)26-11-16-4-2-1-3-5-16/h1-10,14-15,24H,11-13H2,(H,25,31)(H,26,27,28)