N2-phenethyl-9-propan-2-yl-N6-(pyridin-3-ylmethyl)purine-2,6-diamine

Systemtic Name: N2-phenethyl-9-propan-2-yl-N6-(pyridin-3-ylmethyl)purine-2,6-diamine Openeye Name: 9-isopropyl-N2-phenethyl-N6-(3-pyridylmethyl)purine-2,6-diamine CAS Name: N2-phenethyl-9-propan-2-yl-N6-(3-pyridinylmethyl)purine-2,6-diamine IUPAC Name: 2-N-phenethyl-9-propan-2-yl-6-N-(pyridin-3-ylmethyl)purine-2,6-diamine Traditional Name: [9-isopropyl-2-(phenethylamino)purin-6-yl]-(3-pyridylmethyl)amine Formula: C22H25N7 MolecularWeight: 387.4808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=CC=C3)NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CN=CC=C3)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H25N7/c1-16(2)29-15-26-19-20(25-14-18-9-6-11-23-13-18)27-22(28-21(19)29)24-12-10-17-7-4-3-5-8-17/h3-9,11,13,15-16H,10,12,14H2,1-2H3,(H2,24,25,27,28)