2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-8-pyrimidin-5-yl-quinoline

Systemtic Name: 2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-8-pyrimidin-5-yl-quinoline Openeye Name: 2-[4-(3-pyridylmethyl)piperazin-1-yl]-8-pyrimidin-5-yl-quinoline CAS Name: 2-[4-(3-pyridinylmethyl)-1-piperazinyl]-8-(5-pyrimidinyl)quinoline IUPAC Name: 2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-8-pyrimidin-5-ylquinoline Traditional Name: 2-[4-(3-pyridylmethyl)piperazino]-8-(5-pyrimidyl)quinoline Formula: C23H22N6 MolecularWeight: 382.46098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C3=NC4=C(C=CC=C4C5=CN=CN=C5)C=C3

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C3=NC4=C(C=CC=C4C5=CN=CN=C5)C=C3

InChI

InChI=1S/C23H22N6/c1-4-19-6-7-22(27-23(19)21(5-1)20-14-25-17-26-15-20)29-11-9-28(10-12-29)16-18-3-2-8-24-13-18/h1-8,13-15,17H,9-12,16H2