1-[[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propan-2-ol

Systemtic Name: 1-[[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propan-2-ol Openeye Name: 1-[[6-[(4-chlorophenyl)methylamino]-9-isopropyl-purin-2-yl]amino]propan-2-ol CAS Name: 1-[[6-[(4-chlorophenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]-2-propanol IUPAC Name: 1-[[6-[(4-chlorophenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]propan-2-ol Traditional Name: 1-[[6-[(4-chlorobenzyl)amino]-9-isopropyl-purin-2-yl]amino]propan-2-ol Formula: C18H23ClN6O MolecularWeight: 374.86782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)NCC(C)O

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)Cl)NCC(C)O

InChI

InChI=1S/C18H23ClN6O/c1-11(2)25-10-22-15-16(20-9-13-4-6-14(19)7-5-13)23-18(24-17(15)25)21-8-12(3)26/h4-7,10-12,26H,8-9H2,1-3H3,(H2,20,21,23,24)