N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Openeye Name: N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)-4-piperidinecarboxamide IUPAC Name: N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)piperidine-4-carboxamide Traditional Name: N-(3,5-dimethoxyphenyl)-1-(7H-purin-6-yl)isonipecotamide Formula: C19H22N6O3 MolecularWeight: 382.41638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=C3NC=N4)OC

InChI

InChI=1S/C19H22N6O3/c1-27-14-7-13(8-15(9-14)28-2)24-19(26)12-3-5-25(6-4-12)18-16-17(21-10-20-16)22-11-23-18/h7-12H,3-6H2,1-2H3,(H,24,26)(H,20,21,22,23)