N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide

Systemtic Name: N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide Openeye Name: N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide CAS Name: N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)-2-pyrrolidinyl]methoxy]-2-quinolinecarboxamide IUPAC Name: N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide Traditional Name: N-cyclopentyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinaldamide Formula: C25H27N7O2 MolecularWeight: 457.52758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)OCC4CCCN4C5=NC=NC6=C5NC=N6

Isomeric SMILES

C1CCC(C1)NC(=O)C2=NC3=CC=CC=C3C(=C2)OC[C@H]4CCCN4C5=NC=NC6=C5NC=N6

InChI

InChI=1S/C25H27N7O2/c33-25(30-16-6-1-2-7-16)20-12-21(18-9-3-4-10-19(18)31-20)34-13-17-8-5-11-32(17)24-22-23(27-14-26-22)28-15-29-24/h3-4,9-10,12,14-17H,1-2,5-8,11,13H2,(H,30,33)(H,26,27,28,29)/t17-/m1/s1