N-(1H-indol-4-yl)-1-(9-methylpurin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-(1H-indol-4-yl)-1-(9-methylpurin-6-yl)piperidine-4-carboxamide Openeye Name: N-(1H-indol-4-yl)-1-(9-methylpurin-6-yl)piperidine-4-carboxamide CAS Name: N-(1H-indol-4-yl)-1-(9-methyl-6-purinyl)-4-piperidinecarboxamide IUPAC Name: N-(1H-indol-4-yl)-1-(9-methylpurin-6-yl)piperidine-4-carboxamide Traditional Name: N-(1H-indol-4-yl)-1-(9-methylpurin-6-yl)isonipecotamide Formula: C20H21N7O MolecularWeight: 375.42704

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1N=CN=C2N3CCC(CC3)C(=O)NC4=CC=CC5=C4C=CN5

Isomeric SMILES

CN1C=NC2=C1N=CN=C2N3CCC(CC3)C(=O)NC4=CC=CC5=C4C=CN5

InChI

InChI=1S/C20H21N7O/c1-26-12-24-17-18(26)22-11-23-19(17)27-9-6-13(7-10-27)20(28)25-16-4-2-3-15-14(16)5-8-21-15/h2-5,8,11-13,21H,6-7,9-10H2,1H3,(H,25,28)