N2-(2-azanylethyl)-N6-(phenylmethyl)-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-(2-azanylethyl)-N6-(phenylmethyl)-9-propan-2-yl-purine-2,6-diamine Openeye Name: N2-(2-aminoethyl)-N6-benzyl-9-isopropyl-purine-2,6-diamine CAS Name: N2-(2-aminoethyl)-N6-(phenylmethyl)-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 2-N-(2-aminoethyl)-6-N-benzyl-9-propan-2-ylpurine-2,6-diamine Traditional Name: 2-aminoethyl-[6-(benzylamino)-9-isopropyl-purin-2-yl]amine Formula: C17H23N7 MolecularWeight: 325.41142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NCCN

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NCCN

InChI

InChI=1S/C17H23N7/c1-12(2)24-11-21-14-15(20-10-13-6-4-3-5-7-13)22-17(19-9-8-18)23-16(14)24/h3-7,11-12H,8-10,18H2,1-2H3,(H2,19,20,22,23)