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

Systemtic Name: 1-(2-chloranyl-7H-purin-6-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(2-chloro-7H-purin-6-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxamide CAS Name: 1-(2-chloro-7H-purin-6-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-chloro-7H-purin-6-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(2-chloro-7H-purin-6-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]isonipecotamide Formula: C22H24ClN7O2 MolecularWeight: 453.92466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)C3CCN(CC3)C4=NC(=NC5=C4NC=N5)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CN2)CCNC(=O)C3CCN(CC3)C4=NC(=NC5=C4NC=N5)Cl

InChI

InChI=1S/C22H24ClN7O2/c1-32-15-2-3-16-14(11-25-17(16)10-15)4-7-24-21(31)13-5-8-30(9-6-13)20-18-19(27-12-26-18)28-22(23)29-20/h2-3,10-13,25H,4-9H2,1H3,(H,24,31)(H,26,27,28,29)