(4-pyrimidin-2-ylpiperazin-1-yl)-(2-thiophen-2-ylquinolin-4-yl)methanone

Systemtic Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-thiophen-2-ylquinolin-4-yl)methanone Openeye Name: (4-pyrimidin-2-ylpiperazin-1-yl)-[2-(2-thienyl)-4-quinolyl]methanone CAS Name: [4-(2-pyrimidinyl)-1-piperazinyl]-(2-thiophen-2-yl-4-quinolinyl)methanone IUPAC Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-thiophen-2-ylquinolin-4-yl)methanone Traditional Name: [4-(2-pyrimidyl)piperazino]-[2-(2-thienyl)-4-quinolyl]methanone Formula: C22H19N5OS MolecularWeight: 401.48416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C22H19N5OS/c28-21(26-10-12-27(13-11-26)22-23-8-4-9-24-22)17-15-19(20-7-3-14-29-20)25-18-6-2-1-5-16(17)18/h1-9,14-15H,10-13H2