2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]propan-1-ol

Systemtic Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-purin-2-yl]amino]propan-1-ol Openeye Name: 2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]propan-1-ol CAS Name: 2-[[6-[(phenylmethyl)amino]-9-propan-2-yl-2-purinyl]amino]-1-propanol IUPAC Name: 2-[[6-(benzylamino)-9-propan-2-ylpurin-2-yl]amino]propan-1-ol Traditional Name: 2-[[6-(benzylamino)-9-isopropyl-purin-2-yl]amino]propan-1-ol Formula: C18H24N6O MolecularWeight: 340.42276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NC(C)CO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NC(C)CO

InChI

InChI=1S/C18H24N6O/c1-12(2)24-11-20-15-16(19-9-14-7-5-4-6-8-14)22-18(23-17(15)24)21-13(3)10-25/h4-8,11-13,25H,9-10H2,1-3H3,(H2,19,21,22,23)