N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-[2-(5-chloranyl-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-[2-(5-chloro-1H-indol-3-yl)ethyl]-1-(7H-purin-6-yl)isonipecotamide Formula: C21H22ClN7O MolecularWeight: 423.89868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CNC3=C2C=C(C=C3)Cl)C4=NC=NC5=C4NC=N5

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CNC3=C2C=C(C=C3)Cl)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C21H22ClN7O/c22-15-1-2-17-16(9-15)14(10-24-17)3-6-23-21(30)13-4-7-29(8-5-13)20-18-19(26-11-25-18)27-12-28-20/h1-2,9-13,24H,3-8H2,(H,23,30)(H,25,26,27,28)