N-[1-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propan-2-yl]ethanamide

Systemtic Name: N-[1-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]propan-2-yl]ethanamide Openeye Name: N-[2-[[9-isopropyl-6-[(4-phenylphenyl)methylamino]purin-2-yl]amino]-1-methyl-ethyl]acetamide CAS Name: N-[1-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]propan-2-yl]acetamide IUPAC Name: N-[1-[[6-[(4-phenylphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]propan-2-yl]acetamide Traditional Name: N-[2-[[9-isopropyl-6-[(4-phenylbenzyl)amino]purin-2-yl]amino]-1-methyl-ethyl]acetamide Formula: C26H31N7O MolecularWeight: 457.57064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NCC(C)NC(=O)C

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)NCC(C)NC(=O)C

InChI

InChI=1S/C26H31N7O/c1-17(2)33-16-29-23-24(31-26(32-25(23)33)28-14-18(3)30-19(4)34)27-15-20-10-12-22(13-11-20)21-8-6-5-7-9-21/h5-13,16-18H,14-15H2,1-4H3,(H,30,34)(H2,27,28,31,32)