[2-(1H-pyrazol-4-yl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(1H-pyrazol-4-yl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(1H-pyrazol-4-yl)-4-quinolyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(1H-pyrazol-4-yl)-4-quinolinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(1H-pyrazol-4-yl)quinolin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(1H-pyrazol-4-yl)-4-quinolyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H19N7O MolecularWeight: 385.42186

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CNN=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CNN=C5

InChI

InChI=1S/C21H19N7O/c29-20(27-8-10-28(11-9-27)21-22-6-3-7-23-21)17-12-19(15-13-24-25-14-15)26-18-5-2-1-4-16(17)18/h1-7,12-14H,8-11H2,(H,24,25)