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

Systemtic Name: N-propyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide Openeye Name: N-propyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide CAS Name: N-propyl-4-[[(2R)-1-(7H-purin-6-yl)-2-pyrrolidinyl]methoxy]-2-quinolinecarboxamide IUPAC Name: N-propyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinoline-2-carboxamide Traditional Name: N-propyl-4-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methoxy]quinaldamide Formula: C23H25N7O2 MolecularWeight: 431.4903

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NC2=CC=CC=C2C(=C1)OCC3CCCN3C4=NC=NC5=C4NC=N5

Isomeric SMILES

CCCNC(=O)C1=NC2=CC=CC=C2C(=C1)OC[C@H]3CCCN3C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C23H25N7O2/c1-2-9-24-23(31)18-11-19(16-7-3-4-8-17(16)29-18)32-12-15-6-5-10-30(15)22-20-21(26-13-25-20)27-14-28-22/h3-4,7-8,11,13-15H,2,5-6,9-10,12H2,1H3,(H,24,31)(H,25,26,27,28)/t15-/m1/s1