3-azanyl-6-ethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-6-ethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one Openeye Name: 3-amino-6-ethyl-2-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one CAS Name: 3-amino-6-ethyl-2-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-amino-6-ethyl-2-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one Traditional Name: 3-amino-6-ethyl-2-[4-[4-(2-quinolyl)piperazino]butyl]-5H-pyrrolo[3,2-d]pyrimidin-4-one Formula: C25H31N7O MolecularWeight: 445.55994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N1)C(=O)N(C(=N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)N

Isomeric SMILES

CCC1=CC2=C(N1)C(=O)N(C(=N2)CCCCN3CCN(CC3)C4=NC5=CC=CC=C5C=C4)N

InChI

InChI=1S/C25H31N7O/c1-2-19-17-21-24(27-19)25(33)32(26)23(29-21)9-5-6-12-30-13-15-31(16-14-30)22-11-10-18-7-3-4-8-20(18)28-22/h3-4,7-8,10-11,17,27H,2,5-6,9,12-16,26H2,1H3