N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoquinolin-1-amine

Systemtic Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoquinolin-1-amine Openeye Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoquinolin-1-amine CAS Name: N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-isoquinolinamine IUPAC Name: N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]isoquinolin-1-amine Traditional Name: 1-isoquinolyl-[3-[4-(2-pyrimidyl)piperazino]propyl]amine Formula: C20H24N6 MolecularWeight: 348.44476

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=NC=CC3=CC=CC=C32)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCNC2=NC=CC3=CC=CC=C32)C4=NC=CC=N4

InChI

InChI=1S/C20H24N6/c1-2-6-18-17(5-1)7-11-22-19(18)21-10-4-12-25-13-15-26(16-14-25)20-23-8-3-9-24-20/h1-3,5-9,11H,4,10,12-16H2,(H,21,22)