4-(9-methylpurin-6-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(9-methylpurin-6-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-(9-methylpurin-6-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-(9-methyl-6-purinyl)-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(9-methylpurin-6-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(9-methylpurin-6-yl)-N-(4-phenoxyphenyl)piperazine-1-carboxamide Formula: C23H23N7O2 MolecularWeight: 429.47442

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CN1C=NC2=C1N=CN=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C23H23N7O2/c1-28-16-26-20-21(28)24-15-25-22(20)29-11-13-30(14-12-29)23(31)27-17-7-9-19(10-8-17)32-18-5-3-2-4-6-18/h2-10,15-16H,11-14H2,1H3,(H,27,31)