N-(isoquinolin-5-ylmethyl)-N-methyl-7H-purin-6-amine

Systemtic Name: N-(isoquinolin-5-ylmethyl)-N-methyl-7H-purin-6-amine Openeye Name: N-(5-isoquinolylmethyl)-N-methyl-7H-purin-6-amine CAS Name: N-(5-isoquinolinylmethyl)-N-methyl-7H-purin-6-amine IUPAC Name: N-(isoquinolin-5-ylmethyl)-N-methyl-7H-purin-6-amine Traditional Name: 5-isoquinolylmethyl-methyl-(7H-purin-6-yl)amine Formula: C16H14N6 MolecularWeight: 290.32256

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC2=C1C=CN=C2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

CN(CC1=CC=CC2=C1C=CN=C2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C16H14N6/c1-22(16-14-15(19-9-18-14)20-10-21-16)8-12-4-2-3-11-7-17-6-5-13(11)12/h2-7,9-10H,8H2,1H3,(H,18,19,20,21)